Flow object JSON
{
"flow_object_id": "fo-b457a29bb00df415",
"prefLabel": [
{
"@value": "Trioctyltin",
"@language": "en",
"@lang": "en",
"provenance": {
"prov:wasGeneratedBy": "bootstrap_labels",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
"ecoinvent-3.12"
],
"prov:wasDerivedFrom": "legacy name field"
}
}
],
"altLabel": [
{
"@value": "Stannane, trioctyl-",
"@language": "en",
"@lang": "en",
"provenance": {
"prov:wasGeneratedBy": "consensus_match",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
"CAS:869-59-0",
"ecoinvent-3.12",
"https://commonchemistry.cas.org/detail?cas_rn=869-59-0"
],
"prov:wasDerivedFrom": "common chemistry CAS lookup"
}
},
{
"@value": "Tin, hydrotrioctyl-",
"@language": "en",
"@lang": "en",
"provenance": {
"prov:wasGeneratedBy": "consensus_match",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
"CAS:869-59-0",
"ecoinvent-3.12",
"https://commonchemistry.cas.org/detail?cas_rn=869-59-0"
],
"prov:wasDerivedFrom": "common chemistry CAS lookup"
}
},
{
"@value": "Trioctylstannane",
"@language": "en",
"@lang": "en",
"provenance": {
"prov:wasGeneratedBy": "consensus_match",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
"CAS:869-59-0",
"ecoinvent-3.12",
"https://commonchemistry.cas.org/detail?cas_rn=869-59-0"
],
"prov:wasDerivedFrom": "common chemistry CAS lookup"
}
},
{
"@value": "Trioctyltin hydride",
"@language": "en",
"@lang": "en",
"provenance": {
"prov:wasGeneratedBy": "consensus_match",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
"CAS:869-59-0",
"ecoinvent-3.12",
"https://commonchemistry.cas.org/detail?cas_rn=869-59-0"
],
"prov:wasDerivedFrom": "common chemistry CAS lookup"
}
},
{
"@value": "Tris(n-octyl)stannane",
"@language": "en",
"@lang": "en",
"provenance": {
"prov:wasGeneratedBy": "consensus_match",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
"CAS:869-59-0",
"ecoinvent-3.12",
"https://commonchemistry.cas.org/detail?cas_rn=869-59-0"
],
"prov:wasDerivedFrom": "common chemistry CAS lookup"
}
}
],
"properties": {
"https://w3id.org/chemrof/IUPAC_name": {
"@id": "https://w3id.org/chemrof/IUPAC_name",
"rdfs:label": "IUPAC name",
"@value": [
"Stannane, trioctyl-"
],
"provenance": {
"prov:wasGeneratedBy": "opsin_iupac",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
"Stannane, trioctyl-"
]
},
"attested_by": {
"Stannane, trioctyl-": [
"opsin_iupac"
]
}
},
"https://w3id.org/chemrof/smiles_string": {
"@id": "https://w3id.org/chemrof/smiles_string",
"rdfs:label": "SMILES",
"@value": [
"[CH2]CCCCCCC.[CH2]CCCCCCC.[CH2]CCCCCCC.[H].[Sn]"
],
"provenance": [
{
"prov:wasGeneratedBy": "rdkit_authoritative",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
"InChI=1S/3C8H17.Sn.H/c3*1-3-5-7-8-6-4-2;;/h3*1,3-8H2,2H3;;"
]
},
{
"prov:wasGeneratedBy": "rdkit_post_consensus",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
"[CH2]CCCCCCC.[CH2]CCCCCCC.[CH2]CCCCCCC.[H].[Sn]"
]
}
],
"attested_by": {
"[CH2]CCCCCCC.[CH2]CCCCCCC.[CH2]CCCCCCC.[H].[Sn]": [
"rdkit_authoritative",
"rdkit_post_consensus"
]
}
},
"https://w3id.org/chemrof/inchi2d_string": {
"@id": "https://w3id.org/chemrof/inchi2d_string",
"rdfs:label": "InChI",
"@value": [
"InChI=1S/3C8H17.Sn.H/c3*1-3-5-7-8-6-4-2;;/h3*1,3-8H2,2H3;;"
],
"provenance": [
{
"prov:wasGeneratedBy": "rdkit_authoritative",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
"InChI=1S/3C8H17.Sn.H/c3*1-3-5-7-8-6-4-2;;/h3*1,3-8H2,2H3;;"
]
},
{
"prov:wasGeneratedBy": "rdkit_post_consensus",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
"[CH2]CCCCCCC.[CH2]CCCCCCC.[CH2]CCCCCCC.[H].[Sn]"
]
}
],
"attested_by": {
"InChI=1S/3C8H17.Sn.H/c3*1-3-5-7-8-6-4-2;;/h3*1,3-8H2,2H3;;": [
"rdkit_authoritative",
"rdkit_post_consensus"
]
}
},
"https://w3id.org/chemrof/inchi2d_key_string": {
"@id": "https://w3id.org/chemrof/inchi2d_key_string",
"rdfs:label": "InChIKey",
"@value": [
"IUCXVGIUCHUPIW-UHFFFAOYSA-N"
],
"provenance": [
{
"prov:wasGeneratedBy": "rdkit_authoritative",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
"InChI=1S/3C8H17.Sn.H/c3*1-3-5-7-8-6-4-2;;/h3*1,3-8H2,2H3;;"
]
},
{
"prov:wasGeneratedBy": "rdkit_post_consensus",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
"[CH2]CCCCCCC.[CH2]CCCCCCC.[CH2]CCCCCCC.[H].[Sn]"
]
}
],
"attested_by": {
"IUCXVGIUCHUPIW-UHFFFAOYSA-N": [
"rdkit_authoritative",
"rdkit_post_consensus"
]
}
},
"https://w3id.org/chemrof/molecular_formula": {
"@id": "https://w3id.org/chemrof/molecular_formula",
"rdfs:label": "Molecular formula",
"@value": [
"C24H52Sn"
],
"provenance": [
{
"prov:wasGeneratedBy": "rdkit_authoritative",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
"InChI=1S/3C8H17.Sn.H/c3*1-3-5-7-8-6-4-2;;/h3*1,3-8H2,2H3;;"
]
},
{
"prov:wasGeneratedBy": "rdkit_post_consensus",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
"[CH2]CCCCCCC.[CH2]CCCCCCC.[CH2]CCCCCCC.[H].[Sn]"
]
}
],
"attested_by": {
"C24H52Sn": [
"rdkit_authoritative",
"rdkit_post_consensus"
]
}
},
"https://w3id.org/chemrof/molecular_mass": {
"@id": "https://w3id.org/chemrof/molecular_mass",
"rdfs:label": "Molecular mass",
"@value": [
459.391
],
"provenance": [
{
"prov:wasGeneratedBy": "rdkit_authoritative",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
"InChI=1S/3C8H17.Sn.H/c3*1-3-5-7-8-6-4-2;;/h3*1,3-8H2,2H3;;"
]
},
{
"prov:wasGeneratedBy": "rdkit_post_consensus",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
"[CH2]CCCCCCC.[CH2]CCCCCCC.[CH2]CCCCCCC.[H].[Sn]"
]
}
],
"attested_by": {
"459.391": [
"rdkit_authoritative",
"rdkit_post_consensus"
]
},
"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": [
460.309096
],
"provenance": [
{
"prov:wasGeneratedBy": "rdkit_authoritative",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
"InChI=1S/3C8H17.Sn.H/c3*1-3-5-7-8-6-4-2;;/h3*1,3-8H2,2H3;;"
]
},
{
"prov:wasGeneratedBy": "rdkit_post_consensus",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
"[CH2]CCCCCCC.[CH2]CCCCCCC.[CH2]CCCCCCC.[H].[Sn]"
]
}
],
"attested_by": {
"460.309096": [
"rdkit_authoritative",
"rdkit_post_consensus"
]
},
"http://qudt.org/schema/qudt/hasUnit": "https://vocab.brightway.one/units/unit/GM-PER-MOL"
}
},
"references": [
{
"@id": "https://commonchemistry.cas.org/detail?cas_rn=869-59-0",
"provenance": {
"prov:wasGeneratedBy": "enrich_references.consensus_cas_link",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
"869-59-0"
],
"prov:wasDerivedFrom": "cas_numbers"
}
}
],
"created_from": {
"resolver": "hybrid_name_cas_v1",
"seed_uuid": "e2ee2329-8e3f-484a-a1a7-99316eb2762c",
"seed_source": "ecoinvent-3.12",
"semantic_typing": {
"rule": "multi_component_neutral",
"reason": "",
"types": [
"https://w3id.org/chemrof/MolecularComplex"
],
"provenance": {
"prov:wasGeneratedBy": "semantic_typing.classify",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:wasDerivedFrom": "semantic_typing.rule.multi_component_neutral"
}
}
},
"classifications": {
"http://semanticscience.org/resource/CHEMINF_000446": {
"@value": [
"869-59-0"
],
"rdfs:seeAlso": [
"https://commonchemistry.cas.org/detail?cas_rn=869-59-0"
],
"http://www.w3.org/2004/02/skos/core#exactMatch": [
{
"@id": "https://commonchemistry.cas.org/detail?cas_rn=869-59-0"
}
],
"provenance": {
"prov:wasGeneratedBy": "hybrid_name_cas_v1",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
"ecoinvent-3.12"
],
"prov:wasDerivedFrom": "cas_numbers"
}
}
},
"origin_qualifier": null,
"parent_flow_object_id": null,
"parent_intervention_id": null,
"@type": [
"https://w3id.org/chemrof/MolecularComplex"
]
}
