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Carbarsone

UUID 6cc47085-38cc-418c-bd68-5d17329807d8
Deprecated yes
Replaced By 3753a54e-d131-4e9b-96e3-5c7f2390d698
Flow Object IDfo-ef357c59ddceabbf
Source EF 3.1
Context Environmental → Ground → Unknown
CAS Numbers 121-59-5
EC Numbers 204-484-6
prefLabel
Language Value Provenance
en Carbarsone
altLabel
Language Value Provenance
en amebarsene
en amebarsone
en aminarson
en arsambide
en carbarson
en fenarsone
en leucarsone
en p-Ureidobenzenearsonic acid
en pentarsone
en 4-Carbamylaminophenylarsonic acid
en 4-Ureidobenzenearsonic acid
en 4-Ureidophenylarsonic acid
en <em>N</em>-Carbamoylarsanilic acid
en <em>N</em>-Carbamylarsanilic acid
en <em>p</em>-Arsonophenylurea
en <em>p</em>-Carbamidobenzenearsonic acid
en <em>p</em>-Ureidobenzenearsonic acid
en Amabevan
en Ameban
en Amibiarson
en Aminarsone
en Aminoarson
en Arsanilic acid, <em>N</em>-carbamoyl-
en Arsonic acid, [4-[(aminocarbonyl)amino]phenyl]-
en Carb-O-Sep
en Histocarb
en Kutan
en NSC 32868
en [4-[(Aminocarbonyl)amino]phenyl]arsonic acid
References
Shared Properties
Predicate Value
Formal charge 0
InChIKey WWXBHTZSYYGCSG-UHFFFAOYSA-N
InChI InChI=1S/C7H9AsN2O4/c9-7(11)10-6-3-1-5(2-4-6)8(12,13)14/h1-4H,(H3,9,10,11)(H2,12,13,14)
IUPAC name (4-ureidophenyl)arsonic acid, [4-(aminocarbonylamino)phenyl]arsonic acid, [4-(carbamoylamino)phenyl]arsonic acid
Molecular formula C7H9AsN2O4
Molecular mass 260.081
Monoisotopic mass 259.97783
SMILES C1=CC(=CC=C1NC(=O)N)[As](=O)(O)O, NC(=O)Nc1ccc([As](=O)(O)O)cc1

Source List References

List Version Source Flow UUID Source Flow Name
EF 3.1 6cc47085-38cc-418c-bd68-5d17329807d8 carbarsone

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=carbarsone||dimension=Environmental > media=Air > strata=Ground level > population_density=Urban (>1000 people/square mile); cas=121-59-5; added Common Chemistry CAS names as altLabel: 4-Carbamylaminophenylarsonic acid, 4-Ureidobenzenearsonic acid, 4-Ureidophenylarsonic acid, <em>N</em>-Carbamoylarsanilic acid, <em>N</em>-Carbamylarsanilic acid, <em>p</em>-Arsonophenylurea, <em>p</em>-Carbamidobenzenearsonic acid, <em>p</em>-Ureidobenzenearsonic acid, Amabevan, Ameban, Amibiarson, Aminarsone, Aminoarson, Arsanilic acid, <em>N</em>-carbamoyl-, Arsonic acid, [4-[(aminocarbonyl)amino]phenyl]-, Carb-O-Sep, Histocarb, Kutan, NSC 32868, [4-[(Aminocarbonyl)amino]phenyl]arsonic acid; object_uuid=fo-ef357c59ddceabbf
cas_match_labels 1 consensus_match group_key=carbarsone||dimension=Environmental > media=Air > strata=Ground level > population_density=Urban (>1000 people/square mile); group_sources=['chebi', 'ec_inventory', 'pubchem']; cas_sources={'121-59-5': ['chebi', 'ec_inventory', 'pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-ef357c59ddceabbf: {'121-59-5': 'exactMatch'}

Context Attributes

AttributeValue
dimensionEnvironmental
mediaGround
geographyUnknown

Consensus Changes

Field Old Value New Value Comment
altLabel [{'@value': 'amebarsene', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'chebi_altlabels', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['label:amebarsene', 'http://purl.obolibrary.org/obo/CHEBI_94806', 'EF 3.1'], 'prov:wasDerivedFrom': 'chebi synonym match'}}, {'@value': 'amebarsone', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'chebi_altlabels', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['label:amebarsone', 'http://purl.obolibrary.org/obo/CHEBI_94806', 'EF 3.1'], 'prov:wasDerivedFrom': 'chebi synonym match'}}, {'@value': 'aminarson', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'chebi_altlabels', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['label:aminarson', 'http://purl.obolibrary.org/obo/CHEBI_94806', 'EF 3.1'], 'prov:wasDerivedFrom': 'chebi synonym match'}}, {'@value': 'arsambide', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'chebi_altlabels', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['label:arsambide', 'http://purl.obolibrary.org/obo/CHEBI_94806', 'EF 3.1'], 'prov:wasDerivedFrom': 'chebi synonym match'}}, {'@value': 'carbarson', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'chebi_altlabels', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['label:carbarson', 'http://purl.obolibrary.org/obo/CHEBI_94806', 'EF 3.1'], 'prov:wasDerivedFrom': 'chebi synonym match'}}, {'@value': 'fenarsone', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'chebi_altlabels', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['label:fenarsone', 'http://purl.obolibrary.org/obo/CHEBI_94806', 'EF 3.1'], 'prov:wasDerivedFrom': 'chebi synonym match'}}, {'@value': 'leucarsone', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'chebi_altlabels', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['label:leucarsone', 'http://purl.obolibrary.org/obo/CHEBI_94806', 'EF 3.1'], 'prov:wasDerivedFrom': 'chebi synonym match'}}, {'@value': 'p-Ureidobenzenearsonic acid', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'chebi_altlabels', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['label:p-Ureidobenzenearsonic acid', 'http://purl.obolibrary.org/obo/CHEBI_94806', 'EF 3.1'], 'prov:wasDerivedFrom': 'chebi synonym match'}}, {'@value': 'pentarsone', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'chebi_altlabels', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['label:pentarsone', 'http://purl.obolibrary.org/obo/CHEBI_94806', 'EF 3.1'], 'prov:wasDerivedFrom': 'chebi synonym match'}}] [{'@value': 'amebarsene', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'chebi_altlabels', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['label:amebarsene', 'http://purl.obolibrary.org/obo/CHEBI_94806', 'EF 3.1'], 'prov:wasDerivedFrom': 'chebi synonym match'}}, {'@value': 'amebarsone', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'chebi_altlabels', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['label:amebarsone', 'http://purl.obolibrary.org/obo/CHEBI_94806', 'EF 3.1'], 'prov:wasDerivedFrom': 'chebi synonym match'}}, {'@value': 'aminarson', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'chebi_altlabels', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['label:aminarson', 'http://purl.obolibrary.org/obo/CHEBI_94806', 'EF 3.1'], 'prov:wasDerivedFrom': 'chebi synonym match'}}, {'@value': 'arsambide', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'chebi_altlabels', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['label:arsambide', 'http://purl.obolibrary.org/obo/CHEBI_94806', 'EF 3.1'], 'prov:wasDerivedFrom': 'chebi synonym match'}}, {'@value': 'carbarson', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'chebi_altlabels', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['label:carbarson', 'http://purl.obolibrary.org/obo/CHEBI_94806', 'EF 3.1'], 'prov:wasDerivedFrom': 'chebi synonym match'}}, {'@value': 'fenarsone', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'chebi_altlabels', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['label:fenarsone', 'http://purl.obolibrary.org/obo/CHEBI_94806', 'EF 3.1'], 'prov:wasDerivedFrom': 'chebi synonym match'}}, {'@value': 'leucarsone', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'chebi_altlabels', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['label:leucarsone', 'http://purl.obolibrary.org/obo/CHEBI_94806', 'EF 3.1'], 'prov:wasDerivedFrom': 'chebi synonym match'}}, {'@value': 'p-Ureidobenzenearsonic acid', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'chebi_altlabels', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['label:p-Ureidobenzenearsonic acid', 'http://purl.obolibrary.org/obo/CHEBI_94806', 'EF 3.1'], 'prov:wasDerivedFrom': 'chebi synonym match'}}, {'@value': 'pentarsone', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'chebi_altlabels', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['label:pentarsone', 'http://purl.obolibrary.org/obo/CHEBI_94806', 'EF 3.1'], 'prov:wasDerivedFrom': 'chebi synonym match'}}, {'@value': '4-Carbamylaminophenylarsonic acid', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:121-59-5', 'https://commonchemistry.cas.org/detail?cas_rn=121-59-5'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': '4-Ureidobenzenearsonic acid', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:121-59-5', 'https://commonchemistry.cas.org/detail?cas_rn=121-59-5'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': '4-Ureidophenylarsonic acid', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:121-59-5', 'https://commonchemistry.cas.org/detail?cas_rn=121-59-5'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': '<em>N</em>-Carbamoylarsanilic acid', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:121-59-5', 'https://commonchemistry.cas.org/detail?cas_rn=121-59-5'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': '<em>N</em>-Carbamylarsanilic acid', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:121-59-5', 'https://commonchemistry.cas.org/detail?cas_rn=121-59-5'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': '<em>p</em>-Arsonophenylurea', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:121-59-5', 'https://commonchemistry.cas.org/detail?cas_rn=121-59-5'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': '<em>p</em>-Carbamidobenzenearsonic acid', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:121-59-5', 'https://commonchemistry.cas.org/detail?cas_rn=121-59-5'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': '<em>p</em>-Ureidobenzenearsonic acid', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:121-59-5', 'https://commonchemistry.cas.org/detail?cas_rn=121-59-5'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': 'Amabevan', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:121-59-5', 'https://commonchemistry.cas.org/detail?cas_rn=121-59-5'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': 'Ameban', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:121-59-5', 'https://commonchemistry.cas.org/detail?cas_rn=121-59-5'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': 'Amibiarson', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:121-59-5', 'https://commonchemistry.cas.org/detail?cas_rn=121-59-5'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': 'Aminarsone', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:121-59-5', 'https://commonchemistry.cas.org/detail?cas_rn=121-59-5'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': 'Aminoarson', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:121-59-5', 'https://commonchemistry.cas.org/detail?cas_rn=121-59-5'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': 'Arsanilic acid, <em>N</em>-carbamoyl-', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:121-59-5', 'https://commonchemistry.cas.org/detail?cas_rn=121-59-5'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': 'Arsonic acid, [4-[(aminocarbonyl)amino]phenyl]-', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:121-59-5', 'https://commonchemistry.cas.org/detail?cas_rn=121-59-5'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': 'Carb-O-Sep', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:121-59-5', 'https://commonchemistry.cas.org/detail?cas_rn=121-59-5'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': 'Histocarb', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:121-59-5', 'https://commonchemistry.cas.org/detail?cas_rn=121-59-5'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': 'Kutan', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:121-59-5', 'https://commonchemistry.cas.org/detail?cas_rn=121-59-5'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': 'NSC 32868', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:121-59-5', 'https://commonchemistry.cas.org/detail?cas_rn=121-59-5'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': '[4-[(Aminocarbonyl)amino]phenyl]arsonic acid', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:121-59-5', 'https://commonchemistry.cas.org/detail?cas_rn=121-59-5'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}] group_key=carbarsone||dimension=Environmental > media=Air > strata=Ground level > population_density=Urban (>1000 people/square mile); cas=121-59-5; added Common Chemistry CAS names as altLabel: 4-Carbamylaminophenylarsonic acid, 4-Ureidobenzenearsonic acid, 4-Ureidophenylarsonic acid, <em>N</em>-Carbamoylarsanilic acid, <em>N</em>-Carbamylarsanilic acid, <em>p</em>-Arsonophenylurea, <em>p</em>-Carbamidobenzenearsonic acid, <em>p</em>-Ureidobenzenearsonic acid, Amabevan, Ameban, Amibiarson, Aminarsone, Aminoarson, Arsanilic acid, <em>N</em>-carbamoyl-, Arsonic acid, [4-[(aminocarbonyl)amino]phenyl]-, Carb-O-Sep, Histocarb, Kutan, NSC 32868, [4-[(Aminocarbonyl)amino]phenyl]arsonic acid; object_uuid=fo-ef357c59ddceabbf
cas_match_labels None {'121-59-5': 'exactMatch'} group_key=carbarsone||dimension=Environmental > media=Air > strata=Ground level > population_density=Urban (>1000 people/square mile); group_sources=['chebi', 'ec_inventory', 'pubchem']; cas_sources={'121-59-5': ['chebi', 'ec_inventory', 'pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-ef357c59ddceabbf: {'121-59-5': 'exactMatch'}

PROV-O Consensus Activity Trail

No PROV-O consensus activities found for this flow.

Full Flow JSON

{
  "uuid": "6cc47085-38cc-418c-bd68-5d17329807d8",
  "name": null,
  "cas_numbers": [
    "121-59-5"
  ],
  "ec_numbers": [
    "204-484-6"
  ],
  "context": {
    "dimension": "Environmental",
    "media": "Ground",
    "geography": "Unknown"
  },
  "general_comment": null,
  "synonyms": [],
  "unit": "kg",
  "lcia_methods": [],
  "source": "EF 3.1",
  "identifier": "6cc47085-38cc-418c-bd68-5d17329807d8",
  "input_datasets": [
    "EF 3.1"
  ],
  "source_refs": [
    {
      "list_name": "EF",
      "list_version": "3.1",
      "source_flow_uuid": "6cc47085-38cc-418c-bd68-5d17329807d8",
      "source_flow_name": "carbarsone",
      "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 soil",
          "Emissions to non-agricultural soil"
        ]
      }
    }
  ],
  "prefLabel": [
    {
      "@value": "Carbarsone",
      "@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": "enrich_references",
    "skos:definition": "enrich_references",
    "references": "enrich_references",
    "altLabel": "consensus_match",
    "cas_match_labels": "consensus_match"
  },
  "context_iri": "https://vocab.brightway.one/flow-contexts/envi-grou-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": [
        "C7H9AsN2O4"
      ],
      "rdfs:label": "Molecular formula",
      "provenance": [
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          "prov:wasDerivedFrom": "chebi.basic_property_values.generalized_empirical_formula"
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          "prov:wasDerivedFrom": "pubchem.props.Molecular Formula"
        }
      ]
    },
    "https://w3id.org/chemrof/smiles_string": {
      "@id": "https://w3id.org/chemrof/smiles_string",
      "@value": [
        "C1=CC(=CC=C1NC(=O)N)[As](=O)(O)O",
        "NC(=O)Nc1ccc([As](=O)(O)O)cc1"
      ],
      "rdfs:label": "SMILES",
      "provenance": [
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          "prov:hadPrimarySource": [
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          ],
          "prov:wasDerivedFrom": "chebi.basic_property_values.smiles_string"
        },
        {
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          "prov:hadPrimarySource": [
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          "prov:wasDerivedFrom": "pubchem.props.SMILES"
        }
      ]
    },
    "https://w3id.org/chemrof/inchi2d_string": {
      "@id": "https://w3id.org/chemrof/inchi2d_string",
      "@value": [
        "InChI=1S/C7H9AsN2O4/c9-7(11)10-6-3-1-5(2-4-6)8(12,13)14/h1-4H,(H3,9,10,11)(H2,12,13,14)"
      ],
      "rdfs:label": "InChI",
      "provenance": [
        {
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          "prov:wasDerivedFrom": "chebi.basic_property_values.inchi_string"
        },
        {
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          "prov:hadPrimarySource": [
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          "prov:wasDerivedFrom": "pubchem.props.InChI"
        }
      ]
    },
    "https://w3id.org/chemrof/inchi2d_key_string": {
      "@id": "https://w3id.org/chemrof/inchi2d_key_string",
      "@value": [
        "WWXBHTZSYYGCSG-UHFFFAOYSA-N"
      ],
      "rdfs:label": "InChIKey",
      "provenance": [
        {
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          "prov:wasDerivedFrom": "chebi.basic_property_values.inchi_key_string"
        },
        {
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          "prov:hadPrimarySource": [
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          ],
          "prov:wasDerivedFrom": "pubchem.props.InChIKey"
        }
      ]
    },
    "https://w3id.org/chemrof/molecular_mass": {
      "@id": "https://w3id.org/chemrof/molecular_mass",
      "@value": [
        "260.081"
      ],
      "rdfs:label": "Molecular mass",
      "http://qudt.org/schema/qudt/hasUnit": "https://vocab.brightway.one/units/unit/GM-PER-MOL",
      "provenance": {
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        ],
        "prov:wasDerivedFrom": "chebi.basic_property_values.mass"
      }
    },
    "https://w3id.org/chemrof/monoisotopic_mass": {
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