CHEBI:32155 - stigmatellin A

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ChEBI Name stigmatellin A
ChEBI ID CHEBI:32155
Definition A member of the class of chromones that is isolated from Stigmatella aurantiaca Sg a15.
Stars This entity has been manually annotated by the ChEBI Team.
Secondary ChEBI IDs CHEBI:45754
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Formula C30H42O7
Net Charge 0
Average Mass 514.65030
Monoisotopic Mass 514.293
InChI InChI=1S/C30H42O7/c1-10-18(2)13-11-12-14-22(33-6)21(5)29(36-9)19(3)15-16-23-20(4)27(31)26-24(34-7)17-25(35-8)28(32)30(26)37-23/h10-14,17,19,21-22,29,32H,15-16H2,1-9H3/b13-11+,14-12+,18-10+/t19-,21+,22-,29-/m0/s1
InChIKey UZHDGDDPOPDJGM-CVOZLMQJSA-N
SMILES CO[C@@H](\C=C\C=C\C(\C)=C\C)[C@@H](C)[C@@H](OC)[C@@H](C)CCc1oc2c(O)c(OC)cc(OC)c2c(=O)c1C
Metabolite of Species Details
Stigmatella aurantiaca Sg a15 (NCBI:txid675526) See: PubMed
Roles Classification
Biological Role(s): bacterial metabolite
Any prokaryotic metabolite produced during a metabolic reaction in bacteria.
quinol oxidation site inhibitor
An compound that inhibits quinol oxidation sites.
View more via ChEBI Ontology
ChEBI Ontology
Outgoing stigmatellin A (CHEBI:32155) has role bacterial metabolite (CHEBI:76969)
stigmatellin A (CHEBI:32155) has role quinol oxidation site inhibitor (CHEBI:74352)
stigmatellin A (CHEBI:32155) is a aromatic ether (CHEBI:35618)
stigmatellin A (CHEBI:32155) is a chromones (CHEBI:23238)
stigmatellin A (CHEBI:32155) is a olefinic compound (CHEBI:78840)
stigmatellin A (CHEBI:32155) is a phenols (CHEBI:33853)
IUPAC Name
2-[(3S,4S,5S,6S,7E,9E,11E)-4,6-dimethoxy-3,5,11-trimethyltrideca-7,9,11-trien-1-yl]-8-hydroxy-5,7-dimethoxy-3-methyl-4H-chromen-4-one
Synonym Source
Stigmatellin KEGG COMPOUND
Manual Xrefs Databases
C00018584 KNApSAcK
C12148 KEGG COMPOUND
CPD0-1686 MetaCyc
SMA PDBeChem
Stigmatellin Wikipedia
View more database links
Registry Numbers Types Sources
8595371 Reaxys Registry Number Reaxys
91682-96-1 CAS Registry Number ChemIDplus
Citations Waiting for Citations Types Sources
10840951 PubMed citation Europe PMC
18701458 PubMed citation Europe PMC
24467536 PubMed citation Europe PMC
2987042 PubMed citation Europe PMC
6429114 PubMed citation Europe PMC
Last Modified
11 November 2014