CHEBI:232031 - verapyrone B(1−)

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ChEBI Name verapyrone B(1−)
ChEBI ID CHEBI:232031
ChEBI ASCII Name verapyrone B(1-)
Definition Major microspecies at pH 7.3.
Stars This entity has been manually annotated by a third party.
Submitter Anne Morgat
Supplier Information No supplier information found for this compound.
Download Molfile XML SDF
Formula C34H53O9
Net Charge -1
Average Mass 605.790
Monoisotopic Mass 605.36951
InChI InChI=1S/C34H54O9/c1-8-9-10-11-12-20(2)15-22(4)17-23(5)16-21(3)13-14-26(37)34(6,7)27-18-24(36)28(33(41)43-27)32-31(40)30(39)29(38)25(19-35)42-32/h13-14,16-18,20,23,25-26,29-32,35-40H,8-12,15,19H2,1-7H3/p-1/b14-13+,21-16+,22-17-/t20?,23?,25-,26?,29+,30+,31-,32+/m1/s1
InChIKey WVNKNKDPMFTHSE-BXOOFMHISA-M
SMILES C1(=C(C(OC(=C1)C(C(/C=C/C(=C/C(/C=C(/C)\CC(CCCCCC)C)C)/C)O)(C)C)=O)[C@H]2[C@@H]([C@H]([C@H]([C@H](O2)CO)O)O)O)[O-]
Roles Classification
Biological Role(s): fungal metabolite
Any eukaryotic metabolite produced during a metabolic reaction in fungi, the kingdom that includes microorganisms such as the yeasts and moulds.
View more via ChEBI Ontology
ChEBI Ontology
Outgoing verapyrone B(1−) (CHEBI:232031) has role fungal metabolite (CHEBI:76946)
verapyrone B(1−) (CHEBI:232031) is a monosaccharide derivative (CHEBI:63367)
verapyrone B(1−) (CHEBI:232031) is a pyranone (CHEBI:37963)
Synonym Source
verapyrone B UniProt
Citation Type Source
38545685 PubMed citation SUBMITTER