Flow object JSON
{
"flow_object_id": "fo-3e292c470ec42057",
"prefLabel": [
{
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"@language": "en",
"@lang": "en",
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}
}
],
"altLabel": [],
"properties": {
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"@value": [
"C30H56O6"
],
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},
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{
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],
"prov:wasDerivedFrom": "pubchem.props.Molecular Formula"
},
{
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"prov:hadPrimarySource": [
"CCCCCCCCCCCC(=O)OCC(COC(=O)CCCCCC)OC(=O)CCCCCCC"
]
}
]
},
"https://w3id.org/chemrof/inchi2d_key_string": {
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"@value": [
"QLFNMEAVIXLCHS-UHFFFAOYSA-N"
],
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},
"rdfs:label": "InChIKey",
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{
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},
{
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"prov:hadPrimarySource": [
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}
]
},
"https://w3id.org/chemrof/smiles_string": {
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"@value": [
"CCCCCCCCCCCC(=O)OCC(COC(=O)CCCCCC)OC(=O)CCCCCCC"
],
"attested_by": {
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},
"rdfs:label": "SMILES",
"provenance": [
{
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"prov:wasDerivedFrom": "pubchem.props.SMILES"
},
{
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"prov:hadPrimarySource": [
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]
}
]
},
"https://w3id.org/chemrof/inchi2d_string": {
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"@value": [
"InChI=1S/C30H56O6/c1-4-7-10-13-14-15-16-18-20-23-29(32)35-26-27(25-34-28(31)22-19-12-9-6-3)36-30(33)24-21-17-11-8-5-2/h27H,4-26H2,1-3H3"
],
"attested_by": {
"InChI=1S/C30H56O6/c1-4-7-10-13-14-15-16-18-20-23-29(32)35-26-27(25-34-28(31)22-19-12-9-6-3)36-30(33)24-21-17-11-8-5-2/h27H,4-26H2,1-3H3": [
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},
"rdfs:label": "InChI",
"provenance": [
{
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"prov:wasDerivedFrom": "pubchem.props.InChI"
},
{
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]
}
]
},
"https://w3id.org/chemrof/IUPAC_name": {
"@id": "https://w3id.org/chemrof/IUPAC_name",
"@value": [
"(3-heptanoyloxy-2-octanoyloxy-propyl) dodecanoate",
"(3-heptanoyloxy-2-octanoyloxypropyl) dodecanoate",
"dodecanoic acid [3-(1-oxoheptoxy)-2-(1-oxooctoxy)propyl] ester",
"lauric acid (2-caprylyloxy-3-enanthyloxy-propyl) ester"
],
"attested_by": {
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],
"(3-heptanoyloxy-2-octanoyloxypropyl) dodecanoate": [
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],
"dodecanoic acid [3-(1-oxoheptoxy)-2-(1-oxooctoxy)propyl] ester": [
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],
"lauric acid (2-caprylyloxy-3-enanthyloxy-propyl) ester": [
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},
"rdfs:label": "IUPAC name",
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],
"prov:wasDerivedFrom": "pubchem.identifiers.IUPAC Name"
}
},
"https://w3id.org/chemrof/molecular_mass": {
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"rdfs:label": "Molecular mass",
"@value": [
512.772
],
"provenance": [
{
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]
},
{
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]
}
],
"attested_by": {
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},
"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": [
512.40769
],
"provenance": [
{
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]
},
{
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]
}
],
"attested_by": {
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},
"http://qudt.org/schema/qudt/hasUnit": "https://vocab.brightway.one/units/unit/GM-PER-MOL"
}
},
"references": [
{
"@id": "https://commonchemistry.cas.org/detail?cas_rn=68130-53-0",
"provenance": {
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}
},
{
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"prov:wasDerivedFrom": "pubchem.by_cas[68130-53-0]"
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}
],
"created_from": {
"resolver": "hybrid_name_cas_v1",
"seed_uuid": "0976974d-33cc-4f48-872b-ec0070c7db85",
"seed_source": "EF 3.1",
"semantic_typing": {
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"reason": "",
"types": [
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],
"provenance": {
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}
}
},
"classifications": {
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"rdfs:seeAlso": [
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"http://www.w3.org/2004/02/skos/core#exactMatch": [
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},
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],
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"prov:wasDerivedFrom": "ec_numbers"
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},
"origin_qualifier": null,
"parent_flow_object_id": null,
"parent_intervention_id": null,
"@type": [
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]
}
