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Sterigmatocystin

UUID fe0acd60-3ddc-11dd-a1f8-0050c2490048
Deprecated yes
Replaced By fe0acd60-3ddc-11dd-a1f9-0050c2490048
Flow Object IDfo-97fc2b10b435db47
Source EF 3.1
Context Environmental → Water → Unknown
CAS Numbers 10048-13-2
EC Numbers 233-158-6
prefLabel
Language Value Provenance
en Sterigmatocystin
altLabel
Language Value Provenance
en (3aR,12cS)-8-hydroxy-6-methoxy-3a,12c-dihydro-7H-furo[3',2':4,5]furo[2,3-c]xanthen-7-one
en 8-Hydroxy-6-methoxy-3a,12c-dihydro-7H-furo[3',2':4,5]furo[2,3-c]xanthen-7-one
en (3a<em>R</em>,12c<em>S</em>)-3a,12c-Dihydro-8-hydroxy-6-methoxy-7<em>H</em>-furo[3′,2′:4,5]furo[2,3-<em>c</em>]xanthen-7-one
en 7<em>H</em>-Furo[3′,2′:4,5]furo[2,3-<em>c</em>]xanthen-7-one, 3a,12c-dihydro-8-hydroxy-6-methoxy-
en 7<em>H</em>-Furo[3′,2′:4,5]furo[2,3-<em>c</em>]xanthen-7-one, 3a,12c-dihydro-8-hydroxy-6-methoxy-, (3a<em>R</em>,12c<em>S</em>)-
en 7<em>H</em>-Furo[3′,2′:4,5]furo[2,3-<em>c</em>]xanthen-7-one, 3a,12c-dihydro-8-hydroxy-6-methoxy-, (3a<em>R</em>-<em>cis</em>)-
en MeSH ID: D013241
en NSC 201423
en NSC 204985
en Sterigmatocystine
Definitions
Language Value Provenance
en An organic heteropentacyclic compound whose skeleton comprises a xanthene ring system ortho-fused to a dihydrofuranofuran moiety. The parent of the class of sterigmatocystins.
References
Shared Properties
Predicate Value
Formal charge 0
InChIKey UTSVPXMQSFGQTM-DCXZOGHSSA-N
InChI InChI=1S/C18H12O6/c1-21-11-7-12-13(8-5-6-22-18(8)24-12)17-15(11)16(20)14-9(19)3-2-4-10(14)23-17/h2-8,18-19H,1H3/t8-,18+/m0/s1
IUPAC name (3S,7R)-11-methoxy-15-oxidanyl-6,8,20-trioxapentacyclo[10.8.0.02,9.03,7.014,19]icosa-1,4,9,11,14,16,18-heptaen-13-one, (3S,7R)-15-hydroxy-11-methoxy-6,8,20-trioxapentacyclo[10.8.0.02,9.03,7.014,19]eicosa-1,4,9,11,14,16,18-heptaen-13-one, (3S,7R)-15-hydroxy-11-methoxy-6,8,20-trioxapentacyclo[10.8.0.02,9.03,7.014,19]icosa-1,4,9,11,14,16,18-heptaen-13-one
Molecular formula C18H12O6
Molecular mass 324.288
Monoisotopic mass 324.06339
SMILES COC1=C2C(=C3C4C=COC4OC3=C1)OC5=CC=CC(=C5C2=O)O, COC1=C2C(=C3[C@@H]4C=CO[C@@H]4OC3=C1)OC5=CC=CC(=C5C2=O)O, [H][C@]12OC=C[C@@]1([H])c1c(cc(OC)c3c(=O)c4c(O)cccc4oc13)O2

Source List References

List Version Source Flow UUID Source Flow Name
EF 3.1 fe0acd60-3ddc-11dd-a1f8-0050c2490048 sterigmatocystin

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=sterigmatocystin||dimension=Environmental > media=Air > strata=Aircraft cruise height; cas=10048-13-2; added Common Chemistry CAS names as altLabel: (3a<em>R</em>,12c<em>S</em>)-3a,12c-Dihydro-8-hydroxy-6-methoxy-7<em>H</em>-furo[3′,2′:4,5]furo[2,3-<em>c</em>]xanthen-7-one, 7<em>H</em>-Furo[3′,2′:4,5]furo[2,3-<em>c</em>]xanthen-7-one, 3a,12c-dihydro-8-hydroxy-6-methoxy-, 7<em>H</em>-Furo[3′,2′:4,5]furo[2,3-<em>c</em>]xanthen-7-one, 3a,12c-dihydro-8-hydroxy-6-methoxy-, (3a<em>R</em>,12c<em>S</em>)-, 7<em>H</em>-Furo[3′,2′:4,5]furo[2,3-<em>c</em>]xanthen-7-one, 3a,12c-dihydro-8-hydroxy-6-methoxy-, (3a<em>R</em>-<em>cis</em>)-, MeSH ID: D013241, NSC 201423, NSC 204985, Sterigmatocystine; object_uuid=fo-97fc2b10b435db47
cas_match_labels 1 consensus_match group_key=sterigmatocystin||dimension=Environmental > media=Air > strata=Aircraft cruise height; group_sources=['chebi', 'ec_inventory', 'pubchem']; cas_sources={'10048-13-2': ['chebi', 'ec_inventory', 'pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-97fc2b10b435db47: {'10048-13-2': 'exactMatch'}

Context Attributes

AttributeValue
dimensionEnvironmental
mediaWater
water_bodyUnknown

Consensus Changes

Field Old Value New Value Comment
altLabel [{'@value': "(3aR,12cS)-8-hydroxy-6-methoxy-3a,12c-dihydro-7H-furo[3',2':4,5]furo[2,3-c]xanthen-7-one", '@language': 'en', 'source': {'prov:wasGeneratedBy': 'chebi_altlabels', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ["label:(3aR,12cS)-8-hydroxy-6-methoxy-3a,12c-dihydro-7H-furo[3',2':4,5]furo[2,3-c]xanthen-7-one", 'http://purl.obolibrary.org/obo/CHEBI_18227', 'EF 3.1'], 'prov:wasDerivedFrom': 'chebi synonym match'}}, {'@value': "8-Hydroxy-6-methoxy-3a,12c-dihydro-7H-furo[3',2':4,5]furo[2,3-c]xanthen-7-one", '@language': 'en', 'source': {'prov:wasGeneratedBy': 'chebi_altlabels', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ["label:8-Hydroxy-6-methoxy-3a,12c-dihydro-7H-furo[3',2':4,5]furo[2,3-c]xanthen-7-one", 'http://purl.obolibrary.org/obo/CHEBI_18227', 'EF 3.1'], 'prov:wasDerivedFrom': 'chebi synonym match'}}] [{'@value': "(3aR,12cS)-8-hydroxy-6-methoxy-3a,12c-dihydro-7H-furo[3',2':4,5]furo[2,3-c]xanthen-7-one", '@language': 'en', 'source': {'prov:wasGeneratedBy': 'chebi_altlabels', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ["label:(3aR,12cS)-8-hydroxy-6-methoxy-3a,12c-dihydro-7H-furo[3',2':4,5]furo[2,3-c]xanthen-7-one", 'http://purl.obolibrary.org/obo/CHEBI_18227', 'EF 3.1'], 'prov:wasDerivedFrom': 'chebi synonym match'}}, {'@value': "8-Hydroxy-6-methoxy-3a,12c-dihydro-7H-furo[3',2':4,5]furo[2,3-c]xanthen-7-one", '@language': 'en', 'source': {'prov:wasGeneratedBy': 'chebi_altlabels', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ["label:8-Hydroxy-6-methoxy-3a,12c-dihydro-7H-furo[3',2':4,5]furo[2,3-c]xanthen-7-one", 'http://purl.obolibrary.org/obo/CHEBI_18227', 'EF 3.1'], 'prov:wasDerivedFrom': 'chebi synonym match'}}, {'@value': '(3a<em>R</em>,12c<em>S</em>)-3a,12c-Dihydro-8-hydroxy-6-methoxy-7<em>H</em>-furo[3′,2′:4,5]furo[2,3-<em>c</em>]xanthen-7-one', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:10048-13-2', 'https://commonchemistry.cas.org/detail?cas_rn=10048-13-2'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': '7<em>H</em>-Furo[3′,2′:4,5]furo[2,3-<em>c</em>]xanthen-7-one, 3a,12c-dihydro-8-hydroxy-6-methoxy-', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:10048-13-2', 'https://commonchemistry.cas.org/detail?cas_rn=10048-13-2'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': '7<em>H</em>-Furo[3′,2′:4,5]furo[2,3-<em>c</em>]xanthen-7-one, 3a,12c-dihydro-8-hydroxy-6-methoxy-, (3a<em>R</em>,12c<em>S</em>)-', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:10048-13-2', 'https://commonchemistry.cas.org/detail?cas_rn=10048-13-2'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': '7<em>H</em>-Furo[3′,2′:4,5]furo[2,3-<em>c</em>]xanthen-7-one, 3a,12c-dihydro-8-hydroxy-6-methoxy-, (3a<em>R</em>-<em>cis</em>)-', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:10048-13-2', 'https://commonchemistry.cas.org/detail?cas_rn=10048-13-2'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': 'MeSH ID: D013241', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:10048-13-2', 'https://commonchemistry.cas.org/detail?cas_rn=10048-13-2'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': 'NSC 201423', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:10048-13-2', 'https://commonchemistry.cas.org/detail?cas_rn=10048-13-2'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': 'NSC 204985', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:10048-13-2', 'https://commonchemistry.cas.org/detail?cas_rn=10048-13-2'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': 'Sterigmatocystine', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:10048-13-2', 'https://commonchemistry.cas.org/detail?cas_rn=10048-13-2'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}] group_key=sterigmatocystin||dimension=Environmental > media=Air > strata=Aircraft cruise height; cas=10048-13-2; added Common Chemistry CAS names as altLabel: (3a<em>R</em>,12c<em>S</em>)-3a,12c-Dihydro-8-hydroxy-6-methoxy-7<em>H</em>-furo[3′,2′:4,5]furo[2,3-<em>c</em>]xanthen-7-one, 7<em>H</em>-Furo[3′,2′:4,5]furo[2,3-<em>c</em>]xanthen-7-one, 3a,12c-dihydro-8-hydroxy-6-methoxy-, 7<em>H</em>-Furo[3′,2′:4,5]furo[2,3-<em>c</em>]xanthen-7-one, 3a,12c-dihydro-8-hydroxy-6-methoxy-, (3a<em>R</em>,12c<em>S</em>)-, 7<em>H</em>-Furo[3′,2′:4,5]furo[2,3-<em>c</em>]xanthen-7-one, 3a,12c-dihydro-8-hydroxy-6-methoxy-, (3a<em>R</em>-<em>cis</em>)-, MeSH ID: D013241, NSC 201423, NSC 204985, Sterigmatocystine; object_uuid=fo-97fc2b10b435db47
cas_match_labels None {'10048-13-2': 'exactMatch'} group_key=sterigmatocystin||dimension=Environmental > media=Air > strata=Aircraft cruise height; group_sources=['chebi', 'ec_inventory', 'pubchem']; cas_sources={'10048-13-2': ['chebi', 'ec_inventory', 'pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-97fc2b10b435db47: {'10048-13-2': 'exactMatch'}

PROV-O Consensus Activity Trail

No PROV-O consensus activities found for this flow.

Full Flow JSON

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