← Back to consensus flows

Endothall

2D structure
UUID 4d9a8790-3ddd-11dd-8e8b-0050c2490048
Deprecated yes
Replaced By 4d9a8790-3ddd-11dd-8e8c-0050c2490048
Flow Object IDfo-0faa57a189469d9c
Source EF 3.1
Context Environmental → Water → Unknown
CAS Numbers 145-73-3
EC Numbers 205-660-5
prefLabel
Language Value Provenance
en Endothall
altLabel ⓘ
Language Value Provenance
en 1,2-Benzenedicarboxylic acid, hexahydro-3,6-<em>endo</em>-oxy-
en 1,2-Cyclohexanedicarboxylic acid, 3,6-<em>endo</em>-epoxy-
en 3,6-Endooxyphthalic acid, hexahydro-
en 7-Oxabicyclo[2.2.1]heptane-2,3-dicarboxylic acid
en Aquathol
en Aquothol
en Endothal
en Endothalic acid
en Endothallic acid
en Herbon pennout
en Hydout
en Hydrothol
en NSC 112771
References
Shared Properties
Predicate Value
InChIKey GXEKYRXVRROBEV-FBXFSONDSA-N, GXEKYRXVRROBEV-FSIIMWSLSA-N, GXEKYRXVRROBEV-LAXKNYFCSA-N, GXEKYRXVRROBEV-UHFFFAOYSA-N, HDJUOGIUDJDAKC-UHFFFAOYSA-N, RHLALKDQINFLPM-UCDWXUIISA-N, RHLALKDQINFLPM-UHFFFAOYSA-N
InChI InChI=1S/C15H11ClFNO3/c1-8-2-3-9(17)6-12(8)14(19)18-10-4-5-11(15(20)21)13(16)7-10/h2-7H,1H3,(H,18,19)(H,20,21), InChI=1S/C8H10O5.H2O/c9-7(10)5-3-1-2-4(13-3)6(5)8(11)12;/h3-6H,1-2H2,(H,9,10)(H,11,12);1H2, InChI=1S/C8H10O5.H2O/c9-7(10)5-3-1-2-4(13-3)6(5)8(11)12;/h3-6H,1-2H2,(H,9,10)(H,11,12);1H2/t3-,4+,5?,6?;, InChI=1S/C8H10O5/c9-7(10)5-3-1-2-4(13-3)6(5)8(11)12/h3-6H,1-2H2,(H,9,10)(H,11,12), InChI=1S/C8H10O5/c9-7(10)5-3-1-2-4(13-3)6(5)8(11)12/h3-6H,1-2H2,(H,9,10)(H,11,12)/t3-,4+,5-,6+, InChI=1S/C8H10O5/c9-7(10)5-3-1-2-4(13-3)6(5)8(11)12/h3-6H,1-2H2,(H,9,10)(H,11,12)/t3-,4+,5-,6-/m0/s1, InChI=1S/C8H10O5/c9-7(10)5-3-1-2-4(13-3)6(5)8(11)12/h3-6H,1-2H2,(H,9,10)(H,11,12)/t3-,4+,5?,6?
IUPAC name (1R,4S)-7-oxabicyclo[2.2.1]heptane-2,3-dicarboxylic acid;hydrate, (1S,2R,3R,4R)-7-oxabicyclo[2.2.1]heptane-2,3-dicarboxylic acid, (1S,2R,3S,4R)-7-oxabicyclo[2.2.1]heptane-2,3-dicarboxylic acid, (1S,4R)-7-oxabicyclo[2.2.1]heptane-2,3-dicarboxylic acid, 2-chloranyl-4-[(5-fluoranyl-2-methyl-phenyl)carbonylamino]benzoic acid, 2-chloro-4-[(5-fluoro-2-methyl-benzoyl)amino]benzoic acid, 2-chloro-4-[(5-fluoro-2-methylbenzoyl)amino]benzoic acid, 2-chloro-4-[[(5-fluoro-2-methylphenyl)-oxomethyl]amino]benzoic acid, 7-oxabicyclo[2.2.1]heptane-2,3-dicarboxylic acid, 7-oxabicyclo[2.2.1]heptane-2,3-dicarboxylic acid;hydrate
Molecular formula C15H11ClFNO3, C8H10O5, C8H12O6
Molecular mass 186.163
Monoisotopic mass 186.052823
SMILES C1CC2C(C(C1O2)C(=O)O)C(=O)O, C1CC2C(C(C1O2)C(=O)O)C(=O)O.O, C1C[C@H]2C(C([C@@H]1O2)C(=O)O)C(=O)O, C1C[C@H]2C(C([C@@H]1O2)C(=O)O)C(=O)O.O, C1C[C@H]2[C@@H]([C@@H]([C@@H]1O2)C(=O)O)C(=O)O, C1C[C@H]2[C@@H]([C@H]([C@@H]1O2)C(=O)O)C(=O)O, CC1=C(C=C(C=C1)F)C(=O)NC2=CC(=C(C=C2)C(=O)O)Cl, O=C(O)C1C2CCC(O2)C1C(=O)O

Source List References

List Version Source Flow UUID Source Flow Name
EF 3.1 4d9a8790-3ddd-11dd-8e8b-0050c2490048 endothall

Consolidated Field Provenance

0 total PROV activity record(s) for this flow.

Field Change Count Latest Time Transformers Latest Comment
altLabel 1 — consensus_match group_key=endothall||dimension=Environmental > media=Air > strata=Aircraft cruise height; cas=145-73-3; added Common Chemistry CAS names as altLabel: 1,2-Benzenedicarboxylic acid, hexahydro-3,6-<em>endo</em>-oxy-, 1,2-Cyclohexanedicarboxylic acid, 3,6-<em>endo</em>-epoxy-, 3,6-Endooxyphthalic acid, hexahydro-, 7-Oxabicyclo[2.2.1]heptane-2,3-dicarboxylic acid, Aquathol, Aquothol, Endothal, Endothalic acid, Endothallic acid, Herbon pennout, Hydout, Hydrothol, NSC 112771; object_uuid=fo-0faa57a189469d9c
cas_match_labels 1 — consensus_match group_key=endothall||dimension=Environmental > media=Air > strata=Aircraft cruise height; group_sources=['ec_inventory', 'pubchem']; cas_sources={'145-73-3': ['ec_inventory', 'pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-0faa57a189469d9c: {'145-73-3': 'exactMatch'}

Context Attributes

AttributeValue
dimensionEnvironmental
mediaWater
water_bodyUnknown

Consensus Changes

Field Old Value New Value Comment
altLabel None [{'@value': '1,2-Benzenedicarboxylic acid, hexahydro-3,6-<em>endo</em>-oxy-', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:145-73-3', 'https://commonchemistry.cas.org/detail?cas_rn=145-73-3'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': '1,2-Cyclohexanedicarboxylic acid, 3,6-<em>endo</em>-epoxy-', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:145-73-3', 'https://commonchemistry.cas.org/detail?cas_rn=145-73-3'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': '3,6-Endooxyphthalic acid, hexahydro-', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:145-73-3', 'https://commonchemistry.cas.org/detail?cas_rn=145-73-3'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': '7-Oxabicyclo[2.2.1]heptane-2,3-dicarboxylic acid', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:145-73-3', 'https://commonchemistry.cas.org/detail?cas_rn=145-73-3'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': 'Aquathol', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:145-73-3', 'https://commonchemistry.cas.org/detail?cas_rn=145-73-3'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': 'Aquothol', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:145-73-3', 'https://commonchemistry.cas.org/detail?cas_rn=145-73-3'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': 'Endothal', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:145-73-3', 'https://commonchemistry.cas.org/detail?cas_rn=145-73-3'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': 'Endothalic acid', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:145-73-3', 'https://commonchemistry.cas.org/detail?cas_rn=145-73-3'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': 'Endothallic acid', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:145-73-3', 'https://commonchemistry.cas.org/detail?cas_rn=145-73-3'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': 'Herbon pennout', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:145-73-3', 'https://commonchemistry.cas.org/detail?cas_rn=145-73-3'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': 'Hydout', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:145-73-3', 'https://commonchemistry.cas.org/detail?cas_rn=145-73-3'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': 'Hydrothol', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:145-73-3', 'https://commonchemistry.cas.org/detail?cas_rn=145-73-3'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': 'NSC 112771', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:145-73-3', 'https://commonchemistry.cas.org/detail?cas_rn=145-73-3'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}] group_key=endothall||dimension=Environmental > media=Air > strata=Aircraft cruise height; cas=145-73-3; added Common Chemistry CAS names as altLabel: 1,2-Benzenedicarboxylic acid, hexahydro-3,6-<em>endo</em>-oxy-, 1,2-Cyclohexanedicarboxylic acid, 3,6-<em>endo</em>-epoxy-, 3,6-Endooxyphthalic acid, hexahydro-, 7-Oxabicyclo[2.2.1]heptane-2,3-dicarboxylic acid, Aquathol, Aquothol, Endothal, Endothalic acid, Endothallic acid, Herbon pennout, Hydout, Hydrothol, NSC 112771; object_uuid=fo-0faa57a189469d9c
cas_match_labels None {'145-73-3': 'exactMatch'} group_key=endothall||dimension=Environmental > media=Air > strata=Aircraft cruise height; group_sources=['ec_inventory', 'pubchem']; cas_sources={'145-73-3': ['ec_inventory', 'pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-0faa57a189469d9c: {'145-73-3': 'exactMatch'}

PROV-O Consensus Activity Trail

No PROV-O consensus activities found for this flow.

Full Flow JSON

{
  "uuid": "4d9a8790-3ddd-11dd-8e8b-0050c2490048",
  "name": null,
  "cas_numbers": [
    "145-73-3"
  ],
  "ec_numbers": [
    "205-660-5"
  ],
  "context": {
    "dimension": "Environmental",
    "media": "Water",
    "water_body": "Unknown"
  },
  "general_comment": null,
  "synonyms": [],
  "unit": "kg",
  "lcia_methods": [],
  "source": "EF 3.1",
  "identifier": "4d9a8790-3ddd-11dd-8e8b-0050c2490048",
  "input_datasets": [
    "EF 3.1"
  ],
  "source_refs": [
    {
      "list_name": "EF",
      "list_version": "3.1",
      "source_flow_uuid": "4d9a8790-3ddd-11dd-8e8b-0050c2490048",
      "source_flow_name": "endothall",
      "source_metadata": {
        "input_file": "/home/cmutel/.local/share/consensus-flow-list/ef-31-flows.json",
        "input_dataset": "EF 3.1",
        "original_context": [
          "Emissions",
          "Emissions to water",
          "Emissions to water, unspecified (long-term)"
        ]
      }
    }
  ],
  "prefLabel": [
    {
      "@value": "Endothall",
      "@language": "en",
      "source": {
        "prov:wasGeneratedBy": "bootstrap_labels",
        "prov:wasAttributedTo": "consensus-flow-list",
        "prov:hadPrimarySource": [
          "EF 3.1"
        ],
        "prov:wasDerivedFrom": "legacy name field"
      }
    }
  ],
  "_sources": {
    "prefLabel": "normalize_name_case",
    "name": "bootstrap_labels",
    "synonyms": "bootstrap_labels",
    "context": "default_context_mapping",
    "context_iri": "default_context_mapping",
    "unit_iri": "unit_normalization",
    "properties": "rdkit_post_consensus",
    "skos:definition": "enrich_references",
    "references": "enrich_references",
    "altLabel": "consensus_match",
    "cas_match_labels": "consensus_match"
  },
  "context_iri": "https://vocab.brightway.one/flow-contexts/envi-wate-unkn",
  "unit_iri": "https://vocab.brightway.one/units/unit/KiloGM",
  "properties": {
    "https://w3id.org/chemrof/molecular_formula": {
      "@id": "https://w3id.org/chemrof/molecular_formula",
      "@value": [
        "C15H11ClFNO3",
        "C8H10O5",
        "C8H12O6"
      ],
      "rdfs:label": "Molecular formula",
      "provenance": [
        {
          "prov:wasGeneratedBy": "enrich_references.pubchem_semantic",
          "prov:wasAttributedTo": "consensus-flow-list",
          "prov:hadPrimarySource": [
            "CID:3225",
            "CID:168842",
            "CID:11112419",
            "CID:12954483",
            "CID:23615703",
            "CID:53440591",
            "CID:71312625"
          ],
          "prov:wasDerivedFrom": "pubchem.props.Molecular Formula"
        },
        {
          "prov:wasGeneratedBy": "rdkit_post_consensus",
          "prov:wasAttributedTo": "consensus-flow-list",
          "prov:hadPrimarySource": [
            "C1CC2C(C(C1O2)C(=O)O)C(=O)O"
          ]
        }
      ]
    },
    "https://w3id.org/chemrof/inchi2d_key_string": {
      "@id": "https://w3id.org/chemrof/inchi2d_key_string",
      "@value": [
        "GXEKYRXVRROBEV-FBXFSONDSA-N",
        "GXEKYRXVRROBEV-FSIIMWSLSA-N",
        "GXEKYRXVRROBEV-LAXKNYFCSA-N",
        "GXEKYRXVRROBEV-UHFFFAOYSA-N",
        "HDJUOGIUDJDAKC-UHFFFAOYSA-N",
        "RHLALKDQINFLPM-UCDWXUIISA-N",
        "RHLALKDQINFLPM-UHFFFAOYSA-N"
      ],
      "rdfs:label": "InChIKey",
      "provenance": [
        {
          "prov:wasGeneratedBy": "enrich_references.pubchem_semantic",
          "prov:wasAttributedTo": "consensus-flow-list",
          "prov:hadPrimarySource": [
            "CID:3225",
            "CID:168842",
            "CID:11112419",
            "CID:12954483",
            "CID:23615703",
            "CID:53440591",
            "CID:71312625"
          ],
          "prov:wasDerivedFrom": "pubchem.props.InChIKey"
        },
        {
          "prov:wasGeneratedBy": "rdkit_post_consensus",
          "prov:wasAttributedTo": "consensus-flow-list",
          "prov:hadPrimarySource": [
            "C1CC2C(C(C1O2)C(=O)O)C(=O)O"
          ]
        }
      ]
    },
    "https://w3id.org/chemrof/smiles_string": {
      "@id": "https://w3id.org/chemrof/smiles_string",
      "@value": [
        "C1CC2C(C(C1O2)C(=O)O)C(=O)O",
        "C1CC2C(C(C1O2)C(=O)O)C(=O)O.O",
        "C1C[C@H]2C(C([C@@H]1O2)C(=O)O)C(=O)O",
        "C1C[C@H]2C(C([C@@H]1O2)C(=O)O)C(=O)O.O",
        "C1C[C@H]2[C@@H]([C@@H]([C@@H]1O2)C(=O)O)C(=O)O",
        "C1C[C@H]2[C@@H]([C@H]([C@@H]1O2)C(=O)O)C(=O)O",
        "CC1=C(C=C(C=C1)F)C(=O)NC2=CC(=C(C=C2)C(=O)O)Cl",
        "O=C(O)C1C2CCC(O2)C1C(=O)O"
      ],
      "rdfs:label": "SMILES",
      "provenance": [
        {
          "prov:wasGeneratedBy": "enrich_references.pubchem_semantic",
          "prov:wasAttributedTo": "consensus-flow-list",
          "prov:hadPrimarySource": [
            "CID:3225",
            "CID:168842",
            "CID:11112419",
            "CID:12954483",
            "CID:23615703",
            "CID:53440591",
            "CID:71312625"
          ],
          "prov:wasDerivedFrom": "pubchem.props.SMILES"
        },
        {
          "prov:wasGeneratedBy": "rdkit_pre_consensus",
          "prov:wasAttributedTo": "consensus-flow-list",
          "prov:hadPrimarySource": [
            "C1CC2C(C(C1O2)C(=O)O)C(=O)O"
          ]
        },
        {
          "prov:wasGeneratedBy": "rdkit_post_consensus",
          "prov:wasAttributedTo": "consensus-flow-list",
          "prov:hadPrimarySource": [
            "C1CC2C(C(C1O2)C(=O)O)C(=O)O"
          ]
        }
      ]
    },
    "https://w3id.org/chemrof/inchi2d_string": {
      "@id": "https://w3id.org/chemrof/inchi2d_string",
      "@value": [
        "InChI=1S/C15H11ClFNO3/c1-8-2-3-9(17)6-12(8)14(19)18-10-4-5-11(15(20)21)13(16)7-10/h2-7H,1H3,(H,18,19)(H,20,21)",
        "InChI=1S/C8H10O5.H2O/c9-7(10)5-3-1-2-4(13-3)6(5)8(11)12;/h3-6H,1-2H2,(H,9,10)(H,11,12);1H2",
        "InChI=1S/C8H10O5.H2O/c9-7(10)5-3-1-2-4(13-3)6(5)8(11)12;/h3-6H,1-2H2,(H,9,10)(H,11,12);1H2/t3-,4+,5?,6?;",
        "InChI=1S/C8H10O5/c9-7(10)5-3-1-2-4(13-3)6(5)8(11)12/h3-6H,1-2H2,(H,9,10)(H,11,12)",
        "InChI=1S/C8H10O5/c9-7(10)5-3-1-2-4(13-3)6(5)8(11)12/h3-6H,1-2H2,(H,9,10)(H,11,12)/t3-,4+,5-,6+",
        "InChI=1S/C8H10O5/c9-7(10)5-3-1-2-4(13-3)6(5)8(11)12/h3-6H,1-2H2,(H,9,10)(H,11,12)/t3-,4+,5-,6-/m0/s1",
        "InChI=1S/C8H10O5/c9-7(10)5-3-1-2-4(13-3)6(5)8(11)12/h3-6H,1-2H2,(H,9,10)(H,11,12)/t3-,4+,5?,6?"
      ],
      "rdfs:label": "InChI",
      "provenance": [
        {
          "prov:wasGeneratedBy": "enrich_references.pubchem_semantic",
          "prov:wasAttributedTo": "consensus-flow-list",
          "prov:hadPrimarySource": [
            "CID:3225",
            "CID:168842",
            "CID:11112419",
            "CID:12954483",
            "CID:23615703",
            "CID:53440591",
            "CID:71312625"
          ],
          "prov:wasDerivedFrom": "pubchem.props.InChI"
        },
        {
          "prov:wasGeneratedBy": "rdkit_post_consensus",
          "prov:wasAttributedTo": "consensus-flow-list",
          "prov:hadPrimarySource": [
            "C1CC2C(C(C1O2)C(=O)O)C(=O)O"
          ]
        }
      ]
    },
    "https://w3id.org/chemrof/IUPAC_name": {
      "@id": "https://w3id.org/chemrof/IUPAC_name",
      "@value": [
        "(1R,4S)-7-oxabicyclo[2.2.1]heptane-2,3-dicarboxylic acid;hydrate",
        "(1S,2R,3R,4R)-7-oxabicyclo[2.2.1]heptane-2,3-dicarboxylic acid",
        "(1S,2R,3S,4R)-7-oxabicyclo[2.2.1]heptane-2,3-dicarboxylic acid",
        "(1S,4R)-7-oxabicyclo[2.2.1]heptane-2,3-dicarboxylic acid",
        "2-chloranyl-4-[(5-fluoranyl-2-methyl-phenyl)carbonylamino]benzoic acid",
        "2-chloro-4-[(5-fluoro-2-methyl-benzoyl)amino]benzoic acid",
        "2-chloro-4-[(5-fluoro-2-methylbenzoyl)amino]benzoic acid",
        "2-chloro-4-[[(5-fluoro-2-methylphenyl)-oxomethyl]amino]benzoic acid",
        "7-oxabicyclo[2.2.1]heptane-2,3-dicarboxylic acid",
        "7-oxabicyclo[2.2.1]heptane-2,3-dicarboxylic acid;hydrate"
      ],
      "rdfs:label": "IUPAC name",
      "provenance": {
        "prov:wasGeneratedBy": "enrich_references.pubchem_semantic",
        "prov:wasAttributedTo": "consensus-flow-list",
        "prov:hadPrimarySource": [
          "CID:3225",
          "CID:168842",
          "CID:11112419",
          "CID:12954483",
          "CID:23615703",
          "CID:53440591",
          "CID:71312625"
        ],
        "prov:wasDerivedFrom": "pubchem.identifiers.IUPAC Name"
      }
    },
    "https://w3id.org/chemrof/molecular_mass": {
      "@id": "https://w3id.org/chemrof/molecular_mass",
      "rdfs:label": "Molecular mass",
      "@value": [
        "186.163"
      ],
      "provenance": [
        {
          "prov:wasGeneratedBy": "rdkit_pre_consensus",
          "prov:wasAttributedTo": "consensus-flow-list",
          "prov:hadPrimarySource": [
            "C1CC2C(C(C1O2)C(=O)O)C(=O)O"
          ]
        },
        {
          "prov:wasGeneratedBy": "rdkit_post_consensus",
          "prov:wasAttributedTo": "consensus-flow-list",
          "prov:hadPrimarySource": [
            "C1CC2C(C(C1O2)C(=O)O)C(=O)O"
          ]
        }
      ],
      "http://qudt.org/schema/qudt/hasUnit": "https://vocab.brightway.one/units/unit/GM-PER-MOL"
    },
    "https://w3id.org/chemrof/monoisotopic_mass": {
      "@id": "https://w3id.org/chemrof/monoisotopic_mass",
      "rdfs:label": "Monoisotopic mass",
      "@value": [
        "186.052823"
      ],
      "provenance": [
        {
          "prov:wasGeneratedBy": "rdkit_pre_consensus",
          "prov:wasAttributedTo": "consensus-flow-list",
          "prov:hadPrimarySource": [
            "C1CC2C(C(C1O2)C(=O)O)C(=O)O"
          ]
        },
        {
          "prov:wasGeneratedBy": "rdkit_post_consensus",
          "prov:wasAttributedTo": "consensus-flow-list",
          "prov:hadPrimarySource": [
            "C1CC2C(C(C1O2)C(=O)O)C(=O)O"
          ]
        }
      ],
      "http://qudt.org/schema/qudt/hasUnit": "https://vocab.brightway.one/units/unit/GM-PER-MOL"
    }
  },
  "skos:definition": [],
  "references": [
    {
      "@id": "http://jglobal.jst.go.jp/en/redirect?Nikkaji_No=J1.634.680B",
      "provenance": {
        "prov:wasGeneratedBy": "enrich_references.pubchem_identifier_url",
        "prov:wasAttributedTo": "consensus-flow-list",
        "prov:hadPrimarySource": [
          "CID:168842;CAS:145-73-3"
        ],
        "prov:wasDerivedFrom": "pubchem.identifiers[145-73-3]"
      }
    },
    {
      "@id": "http://jglobal.jst.go.jp/en/redirect?Nikkaji_No=J3.743.553H",
      "provenance": {
        "prov:wasGeneratedBy": "enrich_references.pubchem_identifier_url",
        "prov:wasAttributedTo": "consensus-flow-list",
        "prov:hadPrimarySource": [
          "CID:12954483;CAS:145-73-3"
        ],
        "prov:wasDerivedFrom": "pubchem.identifiers[145-73-3]"
      }
    },
    {
      "@id": "http://jglobal.jst.go.jp/en/redirect?Nikkaji_No=J5.834C",
      "provenance": {
        "prov:wasGeneratedBy": "enrich_references.pubchem_identifier_url",
        "prov:wasAttributedTo": "consensus-flow-list",
        "prov:hadPrimarySource": [
          "CID:3225;CAS:145-73-3"
        ],
        "prov:wasDerivedFrom": "pubchem.identifiers[145-73-3]"
      }
    },
    {
      "@id": "https://chem.echa.europa.eu/100.005.146",
      "provenance": {
        "prov:wasGeneratedBy": "enrich_references.pubchem_identifier_url",
        "prov:wasAttributedTo": "consensus-flow-list",
        "prov:hadPrimarySource": [
          "CID:168842;CAS:145-73-3"
        ],
        "prov:wasDerivedFrom": "pubchem.identifiers[145-73-3]"
      }
    },
    {
      "@id": "https://chem.echa.europa.eu/100.119.459",
      "provenance": {
        "prov:wasGeneratedBy": "enrich_references.pubchem_identifier_url",
        "prov:wasAttributedTo": "consensus-flow-list",
        "prov:hadPrimarySource": [
          "CID:53440591;CAS:145-73-3"
        ],
        "prov:wasDerivedFrom": "pubchem.identifiers[145-73-3]"
      }
    },
    {
      "@id": "https://chem.echa.europa.eu/100.161.191",
      "provenance": {
        "prov:wasGeneratedBy": "enrich_references.pubchem_identifier_url",
        "prov:wasAttributedTo": "consensus-flow-list",
        "prov:hadPrimarySource": [
          "CID:23615703;CAS:145-73-3"
        ],
        "prov:wasDerivedFrom": "pubchem.identifiers[145-73-3]"
      }
    },
    {
      "@id": "https://commonchemistry.cas.org/detail?cas_rn=145-73-3",
      "provenance": {
        "prov:wasGeneratedBy": "enrich_references.pubchem_identifier_url",
        "prov:wasAttributedTo": "consensus-flow-list",
        "prov:hadPrimarySource": [
          "CID:3225;CAS:145-73-3"
        ],
        "prov:wasDerivedFrom": "pubchem.identifiers[145-73-3]"
      }
    },
    {
      "@id": "https://commonchemistry.cas.org/detail?cas_rn=168080-49-7",
      "provenance": {
        "prov:wasGeneratedBy": "enrich_references.pubchem_identifier_url",
        "prov:wasAttributedTo": "consensus-flow-list",
        "prov:hadPrimarySource": [
          "CID:53440591;CAS:145-73-3"
        ],
        "prov:wasDerivedFrom": "pubchem.identifiers[145-73-3]"
      }
    },
    {
      "@id": "https://commonchemistry.cas.org/detail?cas_rn=28874-46-6",
      "provenance": {
        "prov:wasGeneratedBy": "enrich_references.pubchem_identifier_url",
        "prov:wasAttributedTo": "consensus-flow-list",
        "prov:hadPrimarySource": [
          "CID:168842;CAS:145-73-3"
        ],
        "prov:wasDerivedFrom": "pubchem.identifiers[145-73-3]"
      }
    },
    {
      "@id": "https://comptox.epa.gov/dashboard/DTXSID001165883",
      "provenance": {
        "prov:wasGeneratedBy": "enrich_references.pubchem_identifier_url",
        "prov:wasAttributedTo": "consensus-flow-list",
        "prov:hadPrimarySource": [
          "CID:168842;CAS:145-73-3"
        ],
        "prov:wasDerivedFrom": "pubchem.identifiers[145-73-3]"
      }
    },
    {
      "@id": "https://comptox.epa.gov/dashboard/DTXSID2037710",
      "provenance": {
        "prov:wasGeneratedBy": "enrich_references.pubchem_identifier_url",
        "prov:wasAttributedTo": "consensus-flow-list",
        "prov:hadPrimarySource": [
          "CID:23615703;CAS:145-73-3"
        ],
        "prov:wasDerivedFrom": "pubchem.identifiers[145-73-3]"
      }
    },
    {
      "@id": "https://comptox.epa.gov/dashboard/DTXSID40702672",
      "provenance": {
        "prov:wasGeneratedBy": "enrich_references.pubchem_identifier_url",
        "prov:wasAttributedTo": "consensus-flow-list",
        "prov:hadPrimarySource": [
          "CID:53440591;CAS:145-73-3"
        ],
        "prov:wasDerivedFrom": "pubchem.identifiers[145-73-3]"
      }
    },
    {
      "@id": "https://comptox.epa.gov/dashboard/DTXSID7024081",
      "provenance": {
        "prov:wasGeneratedBy": "enrich_references.pubchem_identifier_url",
        "prov:wasAttributedTo": "consensus-flow-list",
        "prov:hadPrimarySource": [
          "CID:3225;CAS:145-73-3"
        ],
        "prov:wasDerivedFrom": "pubchem.identifiers[145-73-3]"
      }
    },
    {
      "@id": "https://dtp.cancer.gov/dtpstandard/servlet/dwindex?searchtype=NSC&outputformat=html&searchlist=112771",
      "provenance": {
        "prov:wasGeneratedBy": "enrich_references.pubchem_identifier_url",
        "prov:wasAttributedTo": "consensus-flow-list",
        "prov:hadPrimarySource": [
          "CID:3225;CAS:145-73-3"
        ],
        "prov:wasDerivedFrom": "pubchem.identifiers[145-73-3]"
      }
    },
    {
      "@id": "https://dtp.cancer.gov/dtpstandard/servlet/dwindex?searchtype=NSC&outputformat=html&searchlist=237771",
      "provenance": {
        "prov:wasGeneratedBy": "enrich_references.pubchem_identifier_url",
        "prov:wasAttributedTo": "consensus-flow-list",
        "prov:hadPrimarySource": [
          "CID:3225;CAS:145-73-3"
        ],
        "prov:wasDerivedFrom": "pubchem.identifiers[145-73-3]"
      }
    },
    {
      "@id": "https://en.wikipedia.org/wiki/Endothall",
      "provenance": {
        "prov:wasGeneratedBy": "enrich_references.pubchem_identifier_url",
        "prov:wasAttributedTo": "consensus-flow-list",
        "prov:hadPrimarySource": [
          "CID:168842;CAS:145-73-3"
        ],
        "prov:wasDerivedFrom": "pubchem.identifiers[145-73-3]"
      }
    },
    {
      "@id": "https://gsrs.ncats.nih.gov/ginas/app/beta/substances/18F7018HG1",
      "provenance": {
        "prov:wasGeneratedBy": "enrich_references.pubchem_identifier_url",
        "prov:wasAttributedTo": "consensus-flow-list",
        "prov:hadPrimarySource": [
          "CID:168842;CAS:145-73-3"
        ],
        "prov:wasDerivedFrom": "pubchem.identifiers[145-73-3]"
      }
    },
    {
      "@id": "https://pubchem.ncbi.nlm.nih.gov/compound/11112419",
      "provenance": {
        "prov:wasGeneratedBy": "enrich_references.pubchem_compound",
        "prov:wasAttributedTo": "consensus-flow-list",
        "prov:hadPrimarySource": [
          "CID:11112419;CAS:145-73-3"
        ],
        "prov:wasDerivedFrom": "pubchem.by_cas[145-73-3]"
      }
    },
    {
      "@id": "https://pubchem.ncbi.nlm.nih.gov/compound/12954483",
      "provenance": {
        "prov:wasGeneratedBy": "enrich_references.pubchem_compound",
        "prov:wasAttributedTo": "consensus-flow-list",
        "prov:hadPrimarySource": [
          "CID:12954483;CAS:145-73-3"
        ],
        "prov:wasDerivedFrom": "pubchem.by_cas[145-73-3]"
      }
    },
    {
      "@id": "https://pubchem.ncbi.nlm.nih.gov/compound/168842",
      "provenance": {
        "prov:wasGeneratedBy": "enrich_references.pubchem_compound",
        "prov:wasAttributedTo": "consensus-flow-list",
        "prov:hadPrimarySource": [
          "CID:168842;CAS:145-73-3"
        ],
        "prov:wasDerivedFrom": "pubchem.by_cas[145-73-3]"
      }
    },
    {
      "@id": "https://pubchem.ncbi.nlm.nih.gov/compound/23615703",
      "provenance": {
        "prov:wasGeneratedBy": "enrich_references.pubchem_compound",
        "prov:wasAttributedTo": "consensus-flow-list",
        "prov:hadPrimarySource": [
          "CID:23615703;CAS:145-73-3"
        ],
        "prov:wasDerivedFrom": "pubchem.by_cas[145-73-3]"
      }
    },
    {
      "@id": "https://pubchem.ncbi.nlm.nih.gov/compound/3225",
      "provenance": {
        "prov:wasGeneratedBy": "enrich_references.pubchem_compound",
        "prov:wasAttributedTo": "consensus-flow-list",
        "prov:hadPrimarySource": [
          "CID:3225;CAS:145-73-3"
        ],
        "prov:wasDerivedFrom": "pubchem.by_cas[145-73-3]"
      }
    },
    {
      "@id": "https://pubchem.ncbi.nlm.nih.gov/compound/53440591",
      "provenance": {
        "prov:wasGeneratedBy": "enrich_references.pubchem_compound",
        "prov:wasAttributedTo": "consensus-flow-list",
        "prov:hadPrimarySource": [
          "CID:53440591;CAS:145-73-3"
        ],
        "prov:wasDerivedFrom": "pubchem.by_cas[145-73-3]"
      }
    },
    {
      "@id": "https://pubchem.ncbi.nlm.nih.gov/compound/71312625",
      "provenance": {
        "prov:wasGeneratedBy": "enrich_references.pubchem_compound",
        "prov:wasAttributedTo": "consensus-flow-list",
        "prov:hadPrimarySource": [
          "CID:71312625;CAS:145-73-3"
        ],
        "prov:wasDerivedFrom": "pubchem.by_cas[145-73-3]"
      }
    },
    {
      "@id": "https://pubchem.ncbi.nlm.nih.gov/erg/#2811",
      "provenance": {
        "prov:wasGeneratedBy": "enrich_references.pubchem_identifier_url",
        "prov:wasAttributedTo": "consensus-flow-list",
        "prov:hadPrimarySource": [
          "CID:168842;CAS:145-73-3"
        ],
        "prov:wasDerivedFrom": "pubchem.identifiers[145-73-3]"
      }
    },
    {
      "@id": "https://pubchem.ncbi.nlm.nih.gov/substance/?source=niaid&sourceid=128163",
      "provenance": {
        "prov:wasGeneratedBy": "enrich_references.pubchem_identifier_url",
        "prov:wasAttributedTo": "consensus-flow-list",
        "prov:hadPrimarySource": [
          "CID:3225;CAS:145-73-3"
        ],
        "prov:wasDerivedFrom": "pubchem.identifiers[145-73-3]"
      }
    },
    {
      "@id": "https://www.ebi.ac.uk/chembl/explore/compound/CHEMBL1890867",
      "provenance": {
        "prov:wasGeneratedBy": "enrich_references.pubchem_identifier_url",
        "prov:wasAttributedTo": "consensus-flow-list",
        "prov:hadPrimarySource": [
          "CID:23615703;CAS:145-73-3"
        ],
        "prov:wasDerivedFrom": "pubchem.identifiers[145-73-3]"
      }
    },
    {
      "@id": "https://www.ebi.ac.uk/chembl/explore/compound/CHEMBL428650",
      "provenance": {
        "prov:wasGeneratedBy": "enrich_references.pubchem_identifier_url",
        "prov:wasAttributedTo": "consensus-flow-list",
        "prov:hadPrimarySource": [
          "CID:168842;CAS:145-73-3"
        ],
        "prov:wasDerivedFrom": "pubchem.identifiers[145-73-3]"
      }
    },
    {
      "@id": "https://www.ebi.ac.uk/chembl/explore/compound/CHEMBL8080",
      "provenance": {
        "prov:wasGeneratedBy": "enrich_references.pubchem_identifier_url",
        "prov:wasAttributedTo": "consensus-flow-list",
        "prov:hadPrimarySource": [
          "CID:3225;CAS:145-73-3"
        ],
        "prov:wasDerivedFrom": "pubchem.identifiers[145-73-3]"
      }
    },
    {
      "@id": "https://www.wikidata.org/wiki/Q27252004",
      "provenance": {
        "prov:wasGeneratedBy": "enrich_references.pubchem_identifier_url",
        "prov:wasAttributedTo": "consensus-flow-list",
        "prov:hadPrimarySource": [
          "CID:168842;CAS:145-73-3"
        ],
        "prov:wasDerivedFrom": "pubchem.identifiers[145-73-3]"
      }
    },
    {
      "@id": "https://www.wikidata.org/wiki/Q3054030",
      "provenance": {
        "prov:wasGeneratedBy": "enrich_references.pubchem_identifier_url",
        "prov:wasAttributedTo": "consensus-flow-list",
        "prov:hadPrimarySource": [
          "CID:3225;CAS:145-73-3"
        ],
        "prov:wasDerivedFrom": "pubchem.identifiers[145-73-3]"
      }
    },
    {
      "@id": "https://www.wikidata.org/wiki/Q81984093",
      "provenance": {
        "prov:wasGeneratedBy": "enrich_references.pubchem_identifier_url",
        "prov:wasAttributedTo": "consensus-flow-list",
        "prov:hadPrimarySource": [
          "CID:23615703;CAS:145-73-3"
        ],
        "prov:wasDerivedFrom": "pubchem.identifiers[145-73-3]"
      }
    },
    {
      "@id": "https://www.wikidata.org/wiki/Q82634659",
      "provenance": {
        "prov:wasGeneratedBy": "enrich_references.pubchem_identifier_url",
        "prov:wasAttributedTo": "consensus-flow-list",
        "prov:hadPrimarySource": [
          "CID:53440591;CAS:145-73-3"
        ],
        "prov:wasDerivedFrom": "pubchem.identifiers[145-73-3]"
      }
    }
  ],
  "altLabel": [
    {
      "@value": "1,2-Benzenedicarboxylic acid, hexahydro-3,6-<em>endo</em>-oxy-",
      "@language": "en",
      "source": {
        "prov:wasGeneratedBy": "consensus_match",
        "prov:wasAttributedTo": "consensus-flow-list",
        "prov:hadPrimarySource": [
          "CAS:145-73-3",
          "https://commonchemistry.cas.org/detail?cas_rn=145-73-3"
        ],
        "prov:wasDerivedFrom": "common chemistry CAS lookup"
      }
    },
    {
      "@value": "1,2-Cyclohexanedicarboxylic acid, 3,6-<em>endo</em>-epoxy-",
      "@language": "en",
      "source": {
        "prov:wasGeneratedBy": "consensus_match",
        "prov:wasAttributedTo": "consensus-flow-list",
        "prov:hadPrimarySource": [
          "CAS:145-73-3",
          "https://commonchemistry.cas.org/detail?cas_rn=145-73-3"
        ],
        "prov:wasDerivedFrom": "common chemistry CAS lookup"
      }
    },
    {
      "@value": "3,6-Endooxyphthalic acid, hexahydro-",
      "@language": "en",
      "source": {
        "prov:wasGeneratedBy": "consensus_match",
        "prov:wasAttributedTo": "consensus-flow-list",
        "prov:hadPrimarySource": [
          "CAS:145-73-3",
          "https://commonchemistry.cas.org/detail?cas_rn=145-73-3"
        ],
        "prov:wasDerivedFrom": "common chemistry CAS lookup"
      }
    },
    {
      "@value": "7-Oxabicyclo[2.2.1]heptane-2,3-dicarboxylic acid",
      "@language": "en",
      "source": {
        "prov:wasGeneratedBy": "consensus_match",
        "prov:wasAttributedTo": "consensus-flow-list",
        "prov:hadPrimarySource": [
          "CAS:145-73-3",
          "https://commonchemistry.cas.org/detail?cas_rn=145-73-3"
        ],
        "prov:wasDerivedFrom": "common chemistry CAS lookup"
      }
    },
    {
      "@value": "Aquathol",
      "@language": "en",
      "source": {
        "prov:wasGeneratedBy": "consensus_match",
        "prov:wasAttributedTo": "consensus-flow-list",
        "prov:hadPrimarySource": [
          "CAS:145-73-3",
          "https://commonchemistry.cas.org/detail?cas_rn=145-73-3"
        ],
        "prov:wasDerivedFrom": "common chemistry CAS lookup"
      }
    },
    {
      "@value": "Aquothol",
      "@language": "en",
      "source": {
        "prov:wasGeneratedBy": "consensus_match",
        "prov:wasAttributedTo": "consensus-flow-list",
        "prov:hadPrimarySource": [
          "CAS:145-73-3",
          "https://commonchemistry.cas.org/detail?cas_rn=145-73-3"
        ],
        "prov:wasDerivedFrom": "common chemistry CAS lookup"
      }
    },
    {
      "@value": "Endothal",
      "@language": "en",
      "source": {
        "prov:wasGeneratedBy": "consensus_match",
        "prov:wasAttributedTo": "consensus-flow-list",
        "prov:hadPrimarySource": [
          "CAS:145-73-3",
          "https://commonchemistry.cas.org/detail?cas_rn=145-73-3"
        ],
        "prov:wasDerivedFrom": "common chemistry CAS lookup"
      }
    },
    {
      "@value": "Endothalic acid",
      "@language": "en",
      "source": {
        "prov:wasGeneratedBy": "consensus_match",
        "prov:wasAttributedTo": "consensus-flow-list",
        "prov:hadPrimarySource": [
          "CAS:145-73-3",
          "https://commonchemistry.cas.org/detail?cas_rn=145-73-3"
        ],
        "prov:wasDerivedFrom": "common chemistry CAS lookup"
      }
    },
    {
      "@value": "Endothallic acid",
      "@language": "en",
      "source": {
        "prov:wasGeneratedBy": "consensus_match",
        "prov:wasAttributedTo": "consensus-flow-list",
        "prov:hadPrimarySource": [
          "CAS:145-73-3",
          "https://commonchemistry.cas.org/detail?cas_rn=145-73-3"
        ],
        "prov:wasDerivedFrom": "common chemistry CAS lookup"
      }
    },
    {
      "@value": "Herbon pennout",
      "@language": "en",
      "source": {
        "prov:wasGeneratedBy": "consensus_match",
        "prov:wasAttributedTo": "consensus-flow-list",
        "prov:hadPrimarySource": [
          "CAS:145-73-3",
          "https://commonchemistry.cas.org/detail?cas_rn=145-73-3"
        ],
        "prov:wasDerivedFrom": "common chemistry CAS lookup"
      }
    },
    {
      "@value": "Hydout",
      "@language": "en",
      "source": {
        "prov:wasGeneratedBy": "consensus_match",
        "prov:wasAttributedTo": "consensus-flow-list",
        "prov:hadPrimarySource": [
          "CAS:145-73-3",
          "https://commonchemistry.cas.org/detail?cas_rn=145-73-3"
        ],
        "prov:wasDerivedFrom": "common chemistry CAS lookup"
      }
    },
    {
      "@value": "Hydrothol",
      "@language": "en",
      "source": {
        "prov:wasGeneratedBy": "consensus_match",
        "prov:wasAttributedTo": "consensus-flow-list",
        "prov:hadPrimarySource": [
          "CAS:145-73-3",
          "https://commonchemistry.cas.org/detail?cas_rn=145-73-3"
        ],
        "prov:wasDerivedFrom": "common chemistry CAS lookup"
      }
    },
    {
      "@value": "NSC 112771",
      "@language": "en",
      "source": {
        "prov:wasGeneratedBy": "consensus_match",
        "prov:wasAttributedTo": "consensus-flow-list",
        "prov:hadPrimarySource": [
          "CAS:145-73-3",
          "https://commonchemistry.cas.org/detail?cas_rn=145-73-3"
        ],
        "prov:wasDerivedFrom": "common chemistry CAS lookup"
      }
    }
  ],
  "cas_match_labels": {
    "145-73-3": "exactMatch"
  },
  "http://www.w3.org/2002/07/owl#deprecated": true,
  "http://purl.org/dc/terms/isReplacedBy": "urn:uuid:4d9a8790-3ddd-11dd-8e8c-0050c2490048",
  "is_replaced_by_uuid": "4d9a8790-3ddd-11dd-8e8c-0050c2490048",
  "flow_object_id": "fo-0faa57a189469d9c"
}