Brightway Flows 1.0
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Carbonyl Sulfide

fo-188188da00c1f7e1

Identity

Type
Neutral molecule
CAS
463-58-1
EC
207-340-0
Origin
EF 3.1 hybrid_name_cas_v1
Changes
20 across every transformer

Structure

Structure diagram for Carbonyl Sulfide

Alternative labels

11

Properties

PropertyValue
Elemental charge chemrof:elemental_charge 0
InChI2D key string chemrof:inchi2d_key_string JJWKPURADFRFRB-UHFFFAOYSA-N
InChI2D string chemrof:inchi2d_string InChI=1S/COS/c2-1-3
IUPAC name chemrof:IUPAC_name Carbonyl Sulfide
Molecular formula chemrof:molecular_formula COS
Molecular mass chemrof:molecular_mass 60.077
Monoisotopic mass chemrof:monoisotopic_mass 59.966986
SMILES string chemrof:smiles_string O=C=S

Known URLs

16

Where else this substance is described. Collected while the pipeline resolved it — from ChEBI's cross-references, from PubChem's identifier list, and from the CAS number — so a link here is a record the merge actually read, not a search it suggests.

Resource URL Recorded by
CAS Common Chemistry https://commonchemistry.cas.org/detail?cas_rn=463-58-1 enrich_references.chebi_xrefs
ChEBI https://www.ebi.ac.uk/chebi/searchId.do?chebiId=CHEBI:16573 enrich_references.chebi_id_link
chem.echa.europa.eu https://chem.echa.europa.eu/100.006.674 enrich_references.pubchem_identifier_url
comptox.epa.gov https://comptox.epa.gov/dashboard/DTXSID6023949 enrich_references.pubchem_identifier_url
gsrs.ncats.nih.gov https://gsrs.ncats.nih.gov/ginas/app/beta/substances/871UI0ET21 enrich_references.pubchem_identifier_url
HMDB https://hmdb.ca/metabolites/HMDB0249641 enrich_references.pubchem_identifier_url
jglobal.jst.go.jp http://jglobal.jst.go.jp/en/redirect?Nikkaji_No=J2.591G enrich_references.pubchem_identifier_url
KEGG https://www.genome.jp/entry/C07331 enrich_references.chebi_xrefs
kegg.jp https://www.kegg.jp/entry/C07331 enrich_references.pubchem_identifier_url
metabolomicsworkbench.org https://www.metabolomicsworkbench.org/data/StructureData.php?RegNo=50551 enrich_references.pubchem_identifier_url
PubChem https://pubchem.ncbi.nlm.nih.gov/compound/10039 enrich_references.pubchem_compound
PubChem https://pubchem.ncbi.nlm.nih.gov/erg/#2204 enrich_references.pubchem_identifier_url
reaxys reaxys:1697284 enrich_references.chebi_xrefs
umbbd.compound umbbd.compound:c0562 enrich_references.chebi_xrefs
Wikidata https://www.wikidata.org/wiki/Q412371 enrich_references.pubchem_identifier_url
Wikipedia https://en.wikipedia.org/wiki/Carbonyl_sulfide enrich_references.chebi_xrefs

Elementary flows

1
Flow Context Source Unit CFs
cb28e592-6d08-4cfc-8696-74d788f55175 Environmental → Air → Unknown EF 3.1 kg 0

History

Everything that changed this substance (20 changes)

Open the changes page

Full record

Flow object JSON 
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        "prov:hadPrimarySource": [
          "EF 3.1"
        ],
        "prov:wasDerivedFrom": "cas_numbers"
      }
    },
    "http://semanticscience.org/resource/CHEMINF_000447": {
      "@value": [
        "207-340-0"
      ],
      "rdfs:seeAlso": [
        "https://echa.europa.eu/search-for-chemicals?query=207-340-0"
      ],
      "provenance": {
        "prov:wasGeneratedBy": "hybrid_name_cas_v1",
        "prov:wasAttributedTo": "brightway-flows",
        "prov:hadPrimarySource": [
          "EF 3.1"
        ],
        "prov:wasDerivedFrom": "ec_numbers"
      }
    }
  },
  "origin_qualifier": null,
  "parent_flow_object_id": null,
  "parent_intervention_id": null,
  "http://www.w3.org/2004/02/skos/core#definition": [
    {
      "@value": "A one-carbon compound in which the carbon atom is attached to an oxygen and a sulfur atom via double bonds.",
      "@language": "en",
      "provenance": {
        "prov:wasGeneratedBy": "enrich_references.chebi_definition",
        "prov:wasAttributedTo": "brightway-flows",
        "prov:hadPrimarySource": [
          "http://purl.obolibrary.org/obo/CHEBI_16573"
        ],
        "prov:wasDerivedFrom": "chebi.definition"
      }
    }
  ],
  "@type": [
    "https://w3id.org/chemrof/NeutralMolecule"
  ]
}

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You do not need to run a build or clone anything. Name the record and say what your evidence is; the measurement is done for you. How contributing works

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