← Back to consensus flows

Methyl 2,3-o-(1-methylethylidene)-5-o-[(4-methylphenyl)sulfonyl]-ß-d-ribofuranoside

UUID e0732836-2145-46ac-9dcc-62dcc1b7f927
Flow Object IDfo-049c69a2fe02ac58
Source EF 3.1
Context Environmental → Ground → Agricultural
CAS Numbers 4137-56-8
EC Numbers 609-920-2
prefLabel
Language Value Provenance
en Methyl 2,3-o-(1-methylethylidene)-5-o-[(4-methylphenyl)sulfonyl]-ß-d-ribofuranoside
altLabel
Language Value Provenance
en Furo[3,4-<em>d</em>]-1,3-dioxole, β-<span class="text-smallcaps">D</span>-ribofuranoside deriv.
en Methyl 2,3-<em>O</em>-isopropylidene-5-<em>O</em>-<em>p</em>-toluenesulfonyl-β-<span class="text-smallcaps">D</span>-ribofuranoside
en Methyl 2,3-<em>O</em>-isopropylidene-5-<em>O</em>-<em>p</em>-tolylsulfonyl-β-<span class="text-smallcaps">D</span>-ribofuranoside
en Methyl 2,3-<em>O</em>-isopropylidene-5-<em>O</em>-tosyl-<span class="text-smallcaps">D</span>-ribonucleoside
en Methyl 2,3-<em>O</em>-isopropylidene-5-<em>O</em>-tosyl-β-<span class="text-smallcaps">D</span>-ribofuranoside
en Methyl 2,3-<em>O</em>-isopropylidene-5-<em>O</em>-β-toluenesulfonyl-β-<span class="text-smallcaps">D</span>-ribofuranoside
en NSC 85192
en Ribofuranoside, methyl 2,3-<em>O</em>-isopropylidene-, <em>p</em>-toluenesulfonate
en Ribofuranoside, methyl 2,3-<em>O</em>-isopropylidene-, <em>p</em>-toluenesulfonate, β-<span class="text-smallcaps">D</span>-
en β-<span class="text-smallcaps">D</span>-Ribofuranoside, methyl 2,3-<em>O</em>-(1-methylethylidene)-, 4-methylbenzenesulfonate
en β-<span class="text-smallcaps">D</span>-Ribofuranoside, methyl 2,3-<em>O</em>-(1-methylethylidene)-, 5-(4-methylbenzenesulfonate)
References
Shared Properties
Predicate Value
InChIKey IAPMZKRZMYQZSW-AJNGGQMLSA-N, IAPMZKRZMYQZSW-KBUPBQIOSA-N, IAPMZKRZMYQZSW-LXTVHRRPSA-N, IAPMZKRZMYQZSW-RAFNIBEQSA-N, IAPMZKRZMYQZSW-UHFFFAOYSA-N
InChI InChI=1S/C16H22O7S/c1-10-5-7-11(8-6-10)24(17,18)20-9-12-13-14(15(19-4)21-12)23-16(2,3)22-13/h5-8,12-15H,9H2,1-4H3, InChI=1S/C16H22O7S/c1-10-5-7-11(8-6-10)24(17,18)20-9-12-13-14(15(19-4)21-12)23-16(2,3)22-13/h5-8,12-15H,9H2,1-4H3/t12-,13+,14-,15-/m1/s1, InChI=1S/C16H22O7S/c1-10-5-7-11(8-6-10)24(17,18)20-9-12-13-14(15(19-4)21-12)23-16(2,3)22-13/h5-8,12-15H,9H2,1-4H3/t12-,13-,14-,15-/m0/s1, InChI=1S/C16H22O7S/c1-10-5-7-11(8-6-10)24(17,18)20-9-12-13-14(15(19-4)21-12)23-16(2,3)22-13/h5-8,12-15H,9H2,1-4H3/t12-,13-,14-,15-/m1/s1, InChI=1S/C16H22O7S/c1-10-5-7-11(8-6-10)24(17,18)20-9-12-13-14(15(19-4)21-12)23-16(2,3)22-13/h5-8,12-15H,9H2,1-4H3/t12?,13-,14+,15?/m0/s1
IUPAC name (4-methoxy-2,2-dimethyl-3a,4,6,6a-tetrahydrofuro[3,4-d][1,3]dioxol-6-yl)methyl 4-methylbenzenesulfonate, 4-methylbenzenesulfonic acid (4-methoxy-2,2-dimethyl-3a,4,6,6a-tetrahydrofuro[3,4-d][1,3]dioxol-6-yl)methyl ester, 4-methylbenzenesulfonic acid [(3aR,4R,6R,6aR)-4-methoxy-2,2-dimethyl-3a,4,6,6a-tetrahydrofuro[3,4-d][1,3]dioxol-6-yl]methyl ester, 4-methylbenzenesulfonic acid [(3aR,4R,6R,6aS)-4-methoxy-2,2-dimethyl-3a,4,6,6a-tetrahydrofuro[3,4-d][1,3]dioxol-6-yl]methyl ester, 4-methylbenzenesulfonic acid [(3aR,6aS)-4-methoxy-2,2-dimethyl-3a,4,6,6a-tetrahydrofuro[3,4-d][1,3]dioxol-6-yl]methyl ester, 4-methylbenzenesulfonic acid [(3aS,4S,6S,6aS)-4-methoxy-2,2-dimethyl-3a,4,6,6a-tetrahydrofuro[3,4-d][1,3]dioxol-6-yl]methyl ester, [(3aR,4R,6R,6aR)-4-methoxy-2,2-dimethyl-3a,4,6,6a-tetrahydrofuro[3,4-d][1,3]dioxol-6-yl]methyl 4-methylbenzenesulfonate, [(3aR,4R,6R,6aS)-4-methoxy-2,2-dimethyl-3a,4,6,6a-tetrahydrofuro[3,4-d][1,3]dioxol-6-yl]methyl 4-methylbenzenesulfonate, [(3aR,6aS)-4-methoxy-2,2-dimethyl-3a,4,6,6a-tetrahydrofuro[3,4-d][1,3]dioxol-6-yl]methyl 4-methylbenzenesulfonate, [(3aS,4S,6S,6aS)-4-methoxy-2,2-dimethyl-3a,4,6,6a-tetrahydrofuro[3,4-d][1,3]dioxol-6-yl]methyl 4-methylbenzenesulfonate
Molecular formula C16H22O7S
Molecular mass 358.412
Monoisotopic mass 358.108624
SMILES CC1=CC=C(C=C1)S(=O)(=O)OCC2C3C(C(O2)OC)OC(O3)(C)C, CC1=CC=C(C=C1)S(=O)(=O)OCC2[C@H]3[C@H](C(O2)OC)OC(O3)(C)C, CC1=CC=C(C=C1)S(=O)(=O)OC[C@@H]2[C@@H]3[C@H]([C@@H](O2)OC)OC(O3)(C)C, CC1=CC=C(C=C1)S(=O)(=O)OC[C@@H]2[C@H]3[C@H]([C@@H](O2)OC)OC(O3)(C)C, CC1=CC=C(C=C1)S(=O)(=O)OC[C@H]2[C@H]3[C@@H]([C@H](O2)OC)OC(O3)(C)C, COC1OC(COS(=O)(=O)c2ccc(C)cc2)C2OC(C)(C)OC12

Source List References

List Version Source Flow UUID Source Flow Name
EF 3.1 e0732836-2145-46ac-9dcc-62dcc1b7f927 methyl 2,3-o-(1-methylethylidene)-5-o-[(4-methylphenyl)sulfonyl]-ß-d-ribofuranoside

Concept Associations

Source List Source Flow Source Context Unit Match Type Conversion Provenance
EF 3.1 methyl 2,3-o-(1-methylethylidene)-5-o-[(4-methylphenyl)sulfonyl]-ß-d-ribofuranoside Emissions/Emissions to soil/Emissions to agricultural soil kg exactMatch

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=methyl2,3-o-(1-methylethylidene)-5-o-[(4-methylphenyl)sulfonyl]-ß-d-ribofuranoside||dimension=Environmental > media=Air > strata=Ground level > population_density=Rural (<1000 people/square mile); cas=4137-56-8; added Common Chemistry CAS names as altLabel: Furo[3,4-<em>d</em>]-1,3-dioxole, β-<span class="text-smallcaps">D</span>-ribofuranoside deriv., Methyl 2,3-<em>O</em>-isopropylidene-5-<em>O</em>-<em>p</em>-toluenesulfonyl-β-<span class="text-smallcaps">D</span>-ribofuranoside, Methyl 2,3-<em>O</em>-isopropylidene-5-<em>O</em>-<em>p</em>-tolylsulfonyl-β-<span class="text-smallcaps">D</span>-ribofuranoside, Methyl 2,3-<em>O</em>-isopropylidene-5-<em>O</em>-tosyl-<span class="text-smallcaps">D</span>-ribonucleoside, Methyl 2,3-<em>O</em>-isopropylidene-5-<em>O</em>-tosyl-β-<span class="text-smallcaps">D</span>-ribofuranoside, Methyl 2,3-<em>O</em>-isopropylidene-5-<em>O</em>-β-toluenesulfonyl-β-<span class="text-smallcaps">D</span>-ribofuranoside, NSC 85192, Ribofuranoside, methyl 2,3-<em>O</em>-isopropylidene-, <em>p</em>-toluenesulfonate, Ribofuranoside, methyl 2,3-<em>O</em>-isopropylidene-, <em>p</em>-toluenesulfonate, β-<span class="text-smallcaps">D</span>-, β-<span class="text-smallcaps">D</span>-Ribofuranoside, methyl 2,3-<em>O</em>-(1-methylethylidene)-, 4-methylbenzenesulfonate, β-<span class="text-smallcaps">D</span>-Ribofuranoside, methyl 2,3-<em>O</em>-(1-methylethylidene)-, 5-(4-methylbenzenesulfonate); object_uuid=fo-049c69a2fe02ac58
cas_match_labels 1 consensus_match group_key=methyl2,3-o-(1-methylethylidene)-5-o-[(4-methylphenyl)sulfonyl]-ß-d-ribofuranoside||dimension=Environmental > media=Air > strata=Ground level > population_density=Rural (<1000 people/square mile); group_sources=[]; cas_sources={'4137-56-8': []}; assigned CAS labels from group consensus; object_uuid=fo-049c69a2fe02ac58: {'4137-56-8': 'exactMatch'}

Context Attributes

AttributeValue
dimensionEnvironmental
mediaGround
geographyAgricultural

Consensus Changes

Field Old Value New Value Comment
altLabel None [{'@value': 'Furo[3,4-<em>d</em>]-1,3-dioxole, β-<span class="text-smallcaps">D</span>-ribofuranoside deriv.', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:4137-56-8', 'https://commonchemistry.cas.org/detail?cas_rn=4137-56-8'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': 'Methyl 2,3-<em>O</em>-isopropylidene-5-<em>O</em>-<em>p</em>-toluenesulfonyl-β-<span class="text-smallcaps">D</span>-ribofuranoside', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:4137-56-8', 'https://commonchemistry.cas.org/detail?cas_rn=4137-56-8'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': 'Methyl 2,3-<em>O</em>-isopropylidene-5-<em>O</em>-<em>p</em>-tolylsulfonyl-β-<span class="text-smallcaps">D</span>-ribofuranoside', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:4137-56-8', 'https://commonchemistry.cas.org/detail?cas_rn=4137-56-8'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': 'Methyl 2,3-<em>O</em>-isopropylidene-5-<em>O</em>-tosyl-<span class="text-smallcaps">D</span>-ribonucleoside', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:4137-56-8', 'https://commonchemistry.cas.org/detail?cas_rn=4137-56-8'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': 'Methyl 2,3-<em>O</em>-isopropylidene-5-<em>O</em>-tosyl-β-<span class="text-smallcaps">D</span>-ribofuranoside', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:4137-56-8', 'https://commonchemistry.cas.org/detail?cas_rn=4137-56-8'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': 'Methyl 2,3-<em>O</em>-isopropylidene-5-<em>O</em>-β-toluenesulfonyl-β-<span class="text-smallcaps">D</span>-ribofuranoside', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:4137-56-8', 'https://commonchemistry.cas.org/detail?cas_rn=4137-56-8'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': 'NSC 85192', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:4137-56-8', 'https://commonchemistry.cas.org/detail?cas_rn=4137-56-8'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': 'Ribofuranoside, methyl 2,3-<em>O</em>-isopropylidene-, <em>p</em>-toluenesulfonate', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:4137-56-8', 'https://commonchemistry.cas.org/detail?cas_rn=4137-56-8'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': 'Ribofuranoside, methyl 2,3-<em>O</em>-isopropylidene-, <em>p</em>-toluenesulfonate, β-<span class="text-smallcaps">D</span>-', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:4137-56-8', 'https://commonchemistry.cas.org/detail?cas_rn=4137-56-8'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': 'β-<span class="text-smallcaps">D</span>-Ribofuranoside, methyl 2,3-<em>O</em>-(1-methylethylidene)-, 4-methylbenzenesulfonate', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:4137-56-8', 'https://commonchemistry.cas.org/detail?cas_rn=4137-56-8'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': 'β-<span class="text-smallcaps">D</span>-Ribofuranoside, methyl 2,3-<em>O</em>-(1-methylethylidene)-, 5-(4-methylbenzenesulfonate)', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:4137-56-8', 'https://commonchemistry.cas.org/detail?cas_rn=4137-56-8'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}] group_key=methyl2,3-o-(1-methylethylidene)-5-o-[(4-methylphenyl)sulfonyl]-ß-d-ribofuranoside||dimension=Environmental > media=Air > strata=Ground level > population_density=Rural (<1000 people/square mile); cas=4137-56-8; added Common Chemistry CAS names as altLabel: Furo[3,4-<em>d</em>]-1,3-dioxole, β-<span class="text-smallcaps">D</span>-ribofuranoside deriv., Methyl 2,3-<em>O</em>-isopropylidene-5-<em>O</em>-<em>p</em>-toluenesulfonyl-β-<span class="text-smallcaps">D</span>-ribofuranoside, Methyl 2,3-<em>O</em>-isopropylidene-5-<em>O</em>-<em>p</em>-tolylsulfonyl-β-<span class="text-smallcaps">D</span>-ribofuranoside, Methyl 2,3-<em>O</em>-isopropylidene-5-<em>O</em>-tosyl-<span class="text-smallcaps">D</span>-ribonucleoside, Methyl 2,3-<em>O</em>-isopropylidene-5-<em>O</em>-tosyl-β-<span class="text-smallcaps">D</span>-ribofuranoside, Methyl 2,3-<em>O</em>-isopropylidene-5-<em>O</em>-β-toluenesulfonyl-β-<span class="text-smallcaps">D</span>-ribofuranoside, NSC 85192, Ribofuranoside, methyl 2,3-<em>O</em>-isopropylidene-, <em>p</em>-toluenesulfonate, Ribofuranoside, methyl 2,3-<em>O</em>-isopropylidene-, <em>p</em>-toluenesulfonate, β-<span class="text-smallcaps">D</span>-, β-<span class="text-smallcaps">D</span>-Ribofuranoside, methyl 2,3-<em>O</em>-(1-methylethylidene)-, 4-methylbenzenesulfonate, β-<span class="text-smallcaps">D</span>-Ribofuranoside, methyl 2,3-<em>O</em>-(1-methylethylidene)-, 5-(4-methylbenzenesulfonate); object_uuid=fo-049c69a2fe02ac58
cas_match_labels None {'4137-56-8': 'exactMatch'} group_key=methyl2,3-o-(1-methylethylidene)-5-o-[(4-methylphenyl)sulfonyl]-ß-d-ribofuranoside||dimension=Environmental > media=Air > strata=Ground level > population_density=Rural (<1000 people/square mile); group_sources=[]; cas_sources={'4137-56-8': []}; assigned CAS labels from group consensus; object_uuid=fo-049c69a2fe02ac58: {'4137-56-8': 'exactMatch'}

PROV-O Consensus Activity Trail

No PROV-O consensus activities found for this flow.

Full Flow JSON

{
  "uuid": "e0732836-2145-46ac-9dcc-62dcc1b7f927",
  "name": null,
  "cas_numbers": [
    "4137-56-8"
  ],
  "ec_numbers": [
    "609-920-2"
  ],
  "context": {
    "dimension": "Environmental",
    "media": "Ground",
    "geography": "Agricultural"
  },
  "general_comment": null,
  "synonyms": [],
  "unit": "kg",
  "lcia_methods": [
    {
      "method_uuid": "05316e7a-b254-4bea-9cf0-6bf33eb5c630",
      "name": "Ecotoxicity, freshwater",
      "methodology": "Environmental Footprint",
      "impact_category": "Aquatic eco-toxicity",
      "impact_indicator": "Comparative Toxic Unit for ecosystems (CTUe) ",
      "characterization_factor": 241.92
    },
    {
      "method_uuid": "fd530f00-9325-424a-92ef-aaac67922fd9",
      "name": "Ecotoxicity, freshwater_organics",
      "methodology": "Environmental Footprint",
      "impact_category": "Aquatic eco-toxicity",
      "impact_indicator": "Comparative Toxic Unit for ecosystems (CTUe) ",
      "characterization_factor": 241.92
    }
  ],
  "source": "EF 3.1",
  "identifier": "e0732836-2145-46ac-9dcc-62dcc1b7f927",
  "input_datasets": [
    "EF 3.1"
  ],
  "source_refs": [
    {
      "list_name": "EF",
      "list_version": "3.1",
      "source_flow_uuid": "e0732836-2145-46ac-9dcc-62dcc1b7f927",
      "source_flow_name": "methyl 2,3-o-(1-methylethylidene)-5-o-[(4-methylphenyl)sulfonyl]-ß-d-ribofuranoside",
      "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 agricultural soil"
        ]
      }
    }
  ],
  "prefLabel": [
    {
      "@value": "Methyl 2,3-o-(1-methylethylidene)-5-o-[(4-methylphenyl)sulfonyl]-ß-d-ribofuranoside",
      "@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-grou-agri",
  "unit_iri": "https://vocab.brightway.one/units/unit/KiloGM",
  "properties": {
    "https://w3id.org/chemrof/molecular_formula": {
      "@id": "https://w3id.org/chemrof/molecular_formula",
      "@value": [
        "C16H22O7S"
      ],
      "rdfs:label": "Molecular formula",
      "provenance": [
        {
          "prov:wasGeneratedBy": "enrich_references.pubchem_semantic",
          "prov:wasAttributedTo": "consensus-flow-list",
          "prov:hadPrimarySource": [
            "CID:236623",
            "CID:11013769",
            "CID:13830537",
            "CID:22887237",
            "CID:124364318"
          ],
          "prov:wasDerivedFrom": "pubchem.props.Molecular Formula"
        },
        {
          "prov:wasGeneratedBy": "rdkit_post_consensus",
          "prov:wasAttributedTo": "consensus-flow-list",
          "prov:hadPrimarySource": [
            "CC1=CC=C(C=C1)S(=O)(=O)OCC2C3C(C(O2)OC)OC(O3)(C)C"
          ]
        }
      ]
    },
    "https://w3id.org/chemrof/inchi2d_key_string": {
      "@id": "https://w3id.org/chemrof/inchi2d_key_string",
      "@value": [
        "IAPMZKRZMYQZSW-AJNGGQMLSA-N",
        "IAPMZKRZMYQZSW-KBUPBQIOSA-N",
        "IAPMZKRZMYQZSW-LXTVHRRPSA-N",
        "IAPMZKRZMYQZSW-RAFNIBEQSA-N",
        "IAPMZKRZMYQZSW-UHFFFAOYSA-N"
      ],
      "rdfs:label": "InChIKey",
      "provenance": [
        {
          "prov:wasGeneratedBy": "enrich_references.pubchem_semantic",
          "prov:wasAttributedTo": "consensus-flow-list",
          "prov:hadPrimarySource": [
            "CID:236623",
            "CID:11013769",
            "CID:13830537",
            "CID:22887237",
            "CID:124364318"
          ],
          "prov:wasDerivedFrom": "pubchem.props.InChIKey"
        },
        {
          "prov:wasGeneratedBy": "rdkit_post_consensus",
          "prov:wasAttributedTo": "consensus-flow-list",
          "prov:hadPrimarySource": [
            "CC1=CC=C(C=C1)S(=O)(=O)OCC2C3C(C(O2)OC)OC(O3)(C)C"
          ]
        }
      ]
    },
    "https://w3id.org/chemrof/smiles_string": {
      "@id": "https://w3id.org/chemrof/smiles_string",
      "@value": [
        "CC1=CC=C(C=C1)S(=O)(=O)OCC2C3C(C(O2)OC)OC(O3)(C)C",
        "CC1=CC=C(C=C1)S(=O)(=O)OCC2[C@H]3[C@H](C(O2)OC)OC(O3)(C)C",
        "CC1=CC=C(C=C1)S(=O)(=O)OC[C@@H]2[C@@H]3[C@H]([C@@H](O2)OC)OC(O3)(C)C",
        "CC1=CC=C(C=C1)S(=O)(=O)OC[C@@H]2[C@H]3[C@H]([C@@H](O2)OC)OC(O3)(C)C",
        "CC1=CC=C(C=C1)S(=O)(=O)OC[C@H]2[C@H]3[C@@H]([C@H](O2)OC)OC(O3)(C)C",
        "COC1OC(COS(=O)(=O)c2ccc(C)cc2)C2OC(C)(C)OC12"
      ],
      "rdfs:label": "SMILES",
      "provenance": [
        {
          "prov:wasGeneratedBy": "enrich_references.pubchem_semantic",
          "prov:wasAttributedTo": "consensus-flow-list",
          "prov:hadPrimarySource": [
            "CID:236623",
            "CID:11013769",
            "CID:13830537",
            "CID:22887237",
            "CID:124364318"
          ],
          "prov:wasDerivedFrom": "pubchem.props.SMILES"
        },
        {
          "prov:wasGeneratedBy": "rdkit_pre_consensus",
          "prov:wasAttributedTo": "consensus-flow-list",
          "prov:hadPrimarySource": [
            "CC1=CC=C(C=C1)S(=O)(=O)OCC2C3C(C(O2)OC)OC(O3)(C)C"
          ]
        },
        {
          "prov:wasGeneratedBy": "rdkit_post_consensus",
          "prov:wasAttributedTo": "consensus-flow-list",
          "prov:hadPrimarySource": [
            "CC1=CC=C(C=C1)S(=O)(=O)OCC2C3C(C(O2)OC)OC(O3)(C)C"
          ]
        }
      ]
    },
    "https://w3id.org/chemrof/inchi2d_string": {
      "@id": "https://w3id.org/chemrof/inchi2d_string",
      "@value": [
        "InChI=1S/C16H22O7S/c1-10-5-7-11(8-6-10)24(17,18)20-9-12-13-14(15(19-4)21-12)23-16(2,3)22-13/h5-8,12-15H,9H2,1-4H3",
        "InChI=1S/C16H22O7S/c1-10-5-7-11(8-6-10)24(17,18)20-9-12-13-14(15(19-4)21-12)23-16(2,3)22-13/h5-8,12-15H,9H2,1-4H3/t12-,13+,14-,15-/m1/s1",
        "InChI=1S/C16H22O7S/c1-10-5-7-11(8-6-10)24(17,18)20-9-12-13-14(15(19-4)21-12)23-16(2,3)22-13/h5-8,12-15H,9H2,1-4H3/t12-,13-,14-,15-/m0/s1",
        "InChI=1S/C16H22O7S/c1-10-5-7-11(8-6-10)24(17,18)20-9-12-13-14(15(19-4)21-12)23-16(2,3)22-13/h5-8,12-15H,9H2,1-4H3/t12-,13-,14-,15-/m1/s1",
        "InChI=1S/C16H22O7S/c1-10-5-7-11(8-6-10)24(17,18)20-9-12-13-14(15(19-4)21-12)23-16(2,3)22-13/h5-8,12-15H,9H2,1-4H3/t12?,13-,14+,15?/m0/s1"
      ],
      "rdfs:label": "InChI",
      "provenance": [
        {
          "prov:wasGeneratedBy": "enrich_references.pubchem_semantic",
          "prov:wasAttributedTo": "consensus-flow-list",
          "prov:hadPrimarySource": [
            "CID:236623",
            "CID:11013769",
            "CID:13830537",
            "CID:22887237",
            "CID:124364318"
          ],
          "prov:wasDerivedFrom": "pubchem.props.InChI"
        },
        {
          "prov:wasGeneratedBy": "rdkit_post_consensus",
          "prov:wasAttributedTo": "consensus-flow-list",
          "prov:hadPrimarySource": [
            "CC1=CC=C(C=C1)S(=O)(=O)OCC2C3C(C(O2)OC)OC(O3)(C)C"
          ]
        }
      ]
    },
    "https://w3id.org/chemrof/IUPAC_name": {
      "@id": "https://w3id.org/chemrof/IUPAC_name",
      "@value": [
        "(4-methoxy-2,2-dimethyl-3a,4,6,6a-tetrahydrofuro[3,4-d][1,3]dioxol-6-yl)methyl 4-methylbenzenesulfonate",
        "4-methylbenzenesulfonic acid (4-methoxy-2,2-dimethyl-3a,4,6,6a-tetrahydrofuro[3,4-d][1,3]dioxol-6-yl)methyl ester",
        "4-methylbenzenesulfonic acid [(3aR,4R,6R,6aR)-4-methoxy-2,2-dimethyl-3a,4,6,6a-tetrahydrofuro[3,4-d][1,3]dioxol-6-yl]methyl ester",
        "4-methylbenzenesulfonic acid [(3aR,4R,6R,6aS)-4-methoxy-2,2-dimethyl-3a,4,6,6a-tetrahydrofuro[3,4-d][1,3]dioxol-6-yl]methyl ester",
        "4-methylbenzenesulfonic acid [(3aR,6aS)-4-methoxy-2,2-dimethyl-3a,4,6,6a-tetrahydrofuro[3,4-d][1,3]dioxol-6-yl]methyl ester",
        "4-methylbenzenesulfonic acid [(3aS,4S,6S,6aS)-4-methoxy-2,2-dimethyl-3a,4,6,6a-tetrahydrofuro[3,4-d][1,3]dioxol-6-yl]methyl ester",
        "[(3aR,4R,6R,6aR)-4-methoxy-2,2-dimethyl-3a,4,6,6a-tetrahydrofuro[3,4-d][1,3]dioxol-6-yl]methyl 4-methylbenzenesulfonate",
        "[(3aR,4R,6R,6aS)-4-methoxy-2,2-dimethyl-3a,4,6,6a-tetrahydrofuro[3,4-d][1,3]dioxol-6-yl]methyl 4-methylbenzenesulfonate",
        "[(3aR,6aS)-4-methoxy-2,2-dimethyl-3a,4,6,6a-tetrahydrofuro[3,4-d][1,3]dioxol-6-yl]methyl 4-methylbenzenesulfonate",
        "[(3aS,4S,6S,6aS)-4-methoxy-2,2-dimethyl-3a,4,6,6a-tetrahydrofuro[3,4-d][1,3]dioxol-6-yl]methyl 4-methylbenzenesulfonate"
      ],
      "rdfs:label": "IUPAC name",
      "provenance": {
        "prov:wasGeneratedBy": "enrich_references.pubchem_semantic",
        "prov:wasAttributedTo": "consensus-flow-list",
        "prov:hadPrimarySource": [
          "CID:236623",
          "CID:11013769",
          "CID:13830537",
          "CID:22887237",
          "CID:124364318"
        ],
        "prov:wasDerivedFrom": "pubchem.identifiers.IUPAC Name"
      }
    },
    "https://w3id.org/chemrof/molecular_mass": {
      "@id": "https://w3id.org/chemrof/molecular_mass",
      "rdfs:label": "Molecular mass",
      "@value": [
        "358.412"
      ],
      "provenance": [
        {
          "prov:wasGeneratedBy": "rdkit_pre_consensus",
          "prov:wasAttributedTo": "consensus-flow-list",
          "prov:hadPrimarySource": [
            "CC1=CC=C(C=C1)S(=O)(=O)OCC2C3C(C(O2)OC)OC(O3)(C)C"
          ]
        },
        {
          "prov:wasGeneratedBy": "rdkit_post_consensus",
          "prov:wasAttributedTo": "consensus-flow-list",
          "prov:hadPrimarySource": [
            "CC1=CC=C(C=C1)S(=O)(=O)OCC2C3C(C(O2)OC)OC(O3)(C)C"
          ]
        }
      ],
      "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": [
        "358.108624"
      ],
      "provenance": [
        {
          "prov:wasGeneratedBy": "rdkit_pre_consensus",
          "prov:wasAttributedTo": "consensus-flow-list",
          "prov:hadPrimarySource": [
            "CC1=CC=C(C=C1)S(=O)(=O)OCC2C3C(C(O2)OC)OC(O3)(C)C"
          ]
        },
        {
          "prov:wasGeneratedBy": "rdkit_post_consensus",
          "prov:wasAttributedTo": "consensus-flow-list",
          "prov:hadPrimarySource": [
            "CC1=CC=C(C=C1)S(=O)(=O)OCC2C3C(C(O2)OC)OC(O3)(C)C"
          ]
        }
      ],
      "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=J1.578.394J",
      "provenance": {
        "prov:wasGeneratedBy": "enrich_references.pubchem_identifier_url",
        "prov:wasAttributedTo": "consensus-flow-list",
        "prov:hadPrimarySource": [
          "CID:11013769;CAS:4137-56-8"
        ],
        "prov:wasDerivedFrom": "pubchem.identifiers[4137-56-8]"
      }
    },
    {
      "@id": "https://chem.echa.europa.eu/100.119.631",
      "provenance": {
        "prov:wasGeneratedBy": "enrich_references.pubchem_identifier_url",
        "prov:wasAttributedTo": "consensus-flow-list",
        "prov:hadPrimarySource": [
          "CID:236623;CAS:4137-56-8"
        ],
        "prov:wasDerivedFrom": "pubchem.identifiers[4137-56-8]"
      }
    },
    {
      "@id": "https://chem.echa.europa.eu/100.130.006",
      "provenance": {
        "prov:wasGeneratedBy": "enrich_references.pubchem_identifier_url",
        "prov:wasAttributedTo": "consensus-flow-list",
        "prov:hadPrimarySource": [
          "CID:11013769;CAS:4137-56-8"
        ],
        "prov:wasDerivedFrom": "pubchem.identifiers[4137-56-8]"
      }
    },
    {
      "@id": "https://commonchemistry.cas.org/detail?cas_rn=4137-56-8",
      "provenance": {
        "prov:wasGeneratedBy": "enrich_references.pubchem_identifier_url",
        "prov:wasAttributedTo": "consensus-flow-list",
        "prov:hadPrimarySource": [
          "CID:11013769;CAS:4137-56-8"
        ],
        "prov:wasDerivedFrom": "pubchem.identifiers[4137-56-8]"
      }
    },
    {
      "@id": "https://comptox.epa.gov/dashboard/DTXSID50284838",
      "provenance": {
        "prov:wasGeneratedBy": "enrich_references.pubchem_identifier_url",
        "prov:wasAttributedTo": "consensus-flow-list",
        "prov:hadPrimarySource": [
          "CID:11013769;CAS:4137-56-8"
        ],
        "prov:wasDerivedFrom": "pubchem.identifiers[4137-56-8]"
      }
    },
    {
      "@id": "https://comptox.epa.gov/dashboard/DTXSID60989504",
      "provenance": {
        "prov:wasGeneratedBy": "enrich_references.pubchem_identifier_url",
        "prov:wasAttributedTo": "consensus-flow-list",
        "prov:hadPrimarySource": [
          "CID:236623;CAS:4137-56-8"
        ],
        "prov:wasDerivedFrom": "pubchem.identifiers[4137-56-8]"
      }
    },
    {
      "@id": "https://dtp.cancer.gov/dtpstandard/servlet/dwindex?searchtype=NSC&outputformat=html&searchlist=39263",
      "provenance": {
        "prov:wasGeneratedBy": "enrich_references.pubchem_identifier_url",
        "prov:wasAttributedTo": "consensus-flow-list",
        "prov:hadPrimarySource": [
          "CID:236623;CAS:4137-56-8"
        ],
        "prov:wasDerivedFrom": "pubchem.identifiers[4137-56-8]"
      }
    },
    {
      "@id": "https://dtp.cancer.gov/dtpstandard/servlet/dwindex?searchtype=NSC&outputformat=html&searchlist=85192",
      "provenance": {
        "prov:wasGeneratedBy": "enrich_references.pubchem_identifier_url",
        "prov:wasAttributedTo": "consensus-flow-list",
        "prov:hadPrimarySource": [
          "CID:236623;CAS:4137-56-8"
        ],
        "prov:wasDerivedFrom": "pubchem.identifiers[4137-56-8]"
      }
    },
    {
      "@id": "https://gsrs.ncats.nih.gov/ginas/app/beta/substances/FVP47IPF3Z",
      "provenance": {
        "prov:wasGeneratedBy": "enrich_references.pubchem_identifier_url",
        "prov:wasAttributedTo": "consensus-flow-list",
        "prov:hadPrimarySource": [
          "CID:11013769;CAS:4137-56-8"
        ],
        "prov:wasDerivedFrom": "pubchem.identifiers[4137-56-8]"
      }
    },
    {
      "@id": "https://pubchem.ncbi.nlm.nih.gov/compound/11013769",
      "provenance": {
        "prov:wasGeneratedBy": "enrich_references.pubchem_compound",
        "prov:wasAttributedTo": "consensus-flow-list",
        "prov:hadPrimarySource": [
          "CID:11013769;CAS:4137-56-8"
        ],
        "prov:wasDerivedFrom": "pubchem.by_cas[4137-56-8]"
      }
    },
    {
      "@id": "https://pubchem.ncbi.nlm.nih.gov/compound/124364318",
      "provenance": {
        "prov:wasGeneratedBy": "enrich_references.pubchem_compound",
        "prov:wasAttributedTo": "consensus-flow-list",
        "prov:hadPrimarySource": [
          "CID:124364318;CAS:4137-56-8"
        ],
        "prov:wasDerivedFrom": "pubchem.by_cas[4137-56-8]"
      }
    },
    {
      "@id": "https://pubchem.ncbi.nlm.nih.gov/compound/13830537",
      "provenance": {
        "prov:wasGeneratedBy": "enrich_references.pubchem_compound",
        "prov:wasAttributedTo": "consensus-flow-list",
        "prov:hadPrimarySource": [
          "CID:13830537;CAS:4137-56-8"
        ],
        "prov:wasDerivedFrom": "pubchem.by_cas[4137-56-8]"
      }
    },
    {
      "@id": "https://pubchem.ncbi.nlm.nih.gov/compound/22887237",
      "provenance": {
        "prov:wasGeneratedBy": "enrich_references.pubchem_compound",
        "prov:wasAttributedTo": "consensus-flow-list",
        "prov:hadPrimarySource": [
          "CID:22887237;CAS:4137-56-8"
        ],
        "prov:wasDerivedFrom": "pubchem.by_cas[4137-56-8]"
      }
    },
    {
      "@id": "https://pubchem.ncbi.nlm.nih.gov/compound/236623",
      "provenance": {
        "prov:wasGeneratedBy": "enrich_references.pubchem_compound",
        "prov:wasAttributedTo": "consensus-flow-list",
        "prov:hadPrimarySource": [
          "CID:236623;CAS:4137-56-8"
        ],
        "prov:wasDerivedFrom": "pubchem.by_cas[4137-56-8]"
      }
    },
    {
      "@id": "https://www.wikidata.org/wiki/Q27278233",
      "provenance": {
        "prov:wasGeneratedBy": "enrich_references.pubchem_identifier_url",
        "prov:wasAttributedTo": "consensus-flow-list",
        "prov:hadPrimarySource": [
          "CID:11013769;CAS:4137-56-8"
        ],
        "prov:wasDerivedFrom": "pubchem.identifiers[4137-56-8]"
      }
    },
    {
      "@id": "https://www.wikidata.org/wiki/Q82978650",
      "provenance": {
        "prov:wasGeneratedBy": "enrich_references.pubchem_identifier_url",
        "prov:wasAttributedTo": "consensus-flow-list",
        "prov:hadPrimarySource": [
          "CID:236623;CAS:4137-56-8"
        ],
        "prov:wasDerivedFrom": "pubchem.identifiers[4137-56-8]"
      }
    }
  ],
  "altLabel": [
    {
      "@value": "Furo[3,4-<em>d</em>]-1,3-dioxole, β-<span class=\"text-smallcaps\">D</span>-ribofuranoside deriv.",
      "@language": "en",
      "source": {
        "prov:wasGeneratedBy": "consensus_match",
        "prov:wasAttributedTo": "consensus-flow-list",
        "prov:hadPrimarySource": [
          "CAS:4137-56-8",
          "https://commonchemistry.cas.org/detail?cas_rn=4137-56-8"
        ],
        "prov:wasDerivedFrom": "common chemistry CAS lookup"
      }
    },
    {
      "@value": "Methyl 2,3-<em>O</em>-isopropylidene-5-<em>O</em>-<em>p</em>-toluenesulfonyl-β-<span class=\"text-smallcaps\">D</span>-ribofuranoside",
      "@language": "en",
      "source": {
        "prov:wasGeneratedBy": "consensus_match",
        "prov:wasAttributedTo": "consensus-flow-list",
        "prov:hadPrimarySource": [
          "CAS:4137-56-8",
          "https://commonchemistry.cas.org/detail?cas_rn=4137-56-8"
        ],
        "prov:wasDerivedFrom": "common chemistry CAS lookup"
      }
    },
    {
      "@value": "Methyl 2,3-<em>O</em>-isopropylidene-5-<em>O</em>-<em>p</em>-tolylsulfonyl-β-<span class=\"text-smallcaps\">D</span>-ribofuranoside",
      "@language": "en",
      "source": {
        "prov:wasGeneratedBy": "consensus_match",
        "prov:wasAttributedTo": "consensus-flow-list",
        "prov:hadPrimarySource": [
          "CAS:4137-56-8",
          "https://commonchemistry.cas.org/detail?cas_rn=4137-56-8"
        ],
        "prov:wasDerivedFrom": "common chemistry CAS lookup"
      }
    },
    {
      "@value": "Methyl 2,3-<em>O</em>-isopropylidene-5-<em>O</em>-tosyl-<span class=\"text-smallcaps\">D</span>-ribonucleoside",
      "@language": "en",
      "source": {
        "prov:wasGeneratedBy": "consensus_match",
        "prov:wasAttributedTo": "consensus-flow-list",
        "prov:hadPrimarySource": [
          "CAS:4137-56-8",
          "https://commonchemistry.cas.org/detail?cas_rn=4137-56-8"
        ],
        "prov:wasDerivedFrom": "common chemistry CAS lookup"
      }
    },
    {
      "@value": "Methyl 2,3-<em>O</em>-isopropylidene-5-<em>O</em>-tosyl-β-<span class=\"text-smallcaps\">D</span>-ribofuranoside",
      "@language": "en",
      "source": {
        "prov:wasGeneratedBy": "consensus_match",
        "prov:wasAttributedTo": "consensus-flow-list",
        "prov:hadPrimarySource": [
          "CAS:4137-56-8",
          "https://commonchemistry.cas.org/detail?cas_rn=4137-56-8"
        ],
        "prov:wasDerivedFrom": "common chemistry CAS lookup"
      }
    },
    {
      "@value": "Methyl 2,3-<em>O</em>-isopropylidene-5-<em>O</em>-β-toluenesulfonyl-β-<span class=\"text-smallcaps\">D</span>-ribofuranoside",
      "@language": "en",
      "source": {
        "prov:wasGeneratedBy": "consensus_match",
        "prov:wasAttributedTo": "consensus-flow-list",
        "prov:hadPrimarySource": [
          "CAS:4137-56-8",
          "https://commonchemistry.cas.org/detail?cas_rn=4137-56-8"
        ],
        "prov:wasDerivedFrom": "common chemistry CAS lookup"
      }
    },
    {
      "@value": "NSC 85192",
      "@language": "en",
      "source": {
        "prov:wasGeneratedBy": "consensus_match",
        "prov:wasAttributedTo": "consensus-flow-list",
        "prov:hadPrimarySource": [
          "CAS:4137-56-8",
          "https://commonchemistry.cas.org/detail?cas_rn=4137-56-8"
        ],
        "prov:wasDerivedFrom": "common chemistry CAS lookup"
      }
    },
    {
      "@value": "Ribofuranoside, methyl 2,3-<em>O</em>-isopropylidene-, <em>p</em>-toluenesulfonate",
      "@language": "en",
      "source": {
        "prov:wasGeneratedBy": "consensus_match",
        "prov:wasAttributedTo": "consensus-flow-list",
        "prov:hadPrimarySource": [
          "CAS:4137-56-8",
          "https://commonchemistry.cas.org/detail?cas_rn=4137-56-8"
        ],
        "prov:wasDerivedFrom": "common chemistry CAS lookup"
      }
    },
    {
      "@value": "Ribofuranoside, methyl 2,3-<em>O</em>-isopropylidene-, <em>p</em>-toluenesulfonate, β-<span class=\"text-smallcaps\">D</span>-",
      "@language": "en",
      "source": {
        "prov:wasGeneratedBy": "consensus_match",
        "prov:wasAttributedTo": "consensus-flow-list",
        "prov:hadPrimarySource": [
          "CAS:4137-56-8",
          "https://commonchemistry.cas.org/detail?cas_rn=4137-56-8"
        ],
        "prov:wasDerivedFrom": "common chemistry CAS lookup"
      }
    },
    {
      "@value": "β-<span class=\"text-smallcaps\">D</span>-Ribofuranoside, methyl 2,3-<em>O</em>-(1-methylethylidene)-, 4-methylbenzenesulfonate",
      "@language": "en",
      "source": {
        "prov:wasGeneratedBy": "consensus_match",
        "prov:wasAttributedTo": "consensus-flow-list",
        "prov:hadPrimarySource": [
          "CAS:4137-56-8",
          "https://commonchemistry.cas.org/detail?cas_rn=4137-56-8"
        ],
        "prov:wasDerivedFrom": "common chemistry CAS lookup"
      }
    },
    {
      "@value": "β-<span class=\"text-smallcaps\">D</span>-Ribofuranoside, methyl 2,3-<em>O</em>-(1-methylethylidene)-, 5-(4-methylbenzenesulfonate)",
      "@language": "en",
      "source": {
        "prov:wasGeneratedBy": "consensus_match",
        "prov:wasAttributedTo": "consensus-flow-list",
        "prov:hadPrimarySource": [
          "CAS:4137-56-8",
          "https://commonchemistry.cas.org/detail?cas_rn=4137-56-8"
        ],
        "prov:wasDerivedFrom": "common chemistry CAS lookup"
      }
    }
  ],
  "cas_match_labels": {
    "4137-56-8": "exactMatch"
  },
  "concept_associations": [
    {
      "@type": "xkos:ConceptAssociation",
      "xkos:sourceConcept": {
        "@id": "https://vocab.brightway.one/ef/3.1/flow/e0732836-2145-46ac-9dcc-62dcc1b7f927",
        "skos:prefLabel": "methyl 2,3-o-(1-methylethylidene)-5-o-[(4-methylphenyl)sulfonyl]-ß-d-ribofuranoside",
        "context": "Emissions/Emissions to soil/Emissions to agricultural soil",
        "qudt:unit": "kg"
      },
      "xkos:targetConcept": {
        "@id": "https://vocab.brightway.dev/elementary-flows/e0732836-2145-46ac-9dcc-62dcc1b7f927"
      },
      "xkos:mapType": {
        "@id": "http://www.w3.org/2004/02/skos/core#exactMatch"
      },
      "provenance": {
        "prov:wasGeneratedBy": "build_concept_associations",
        "prov:wasAttributedTo": "consensus-flow-list",
        "prov:hadPrimarySource": [
          "https://eplca.jrc.ec.europa.eu/permalink/EF3_1/EF-v3.1.zip"
        ]
      }
    }
  ],
  "flow_object_id": "fo-049c69a2fe02ac58"
}