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CHEBI:222618 - Capoamycin

ChEBI IDCHEBI:222618
ChEBI NameCapoamycin
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC35H38O10
Net Charge0
Average Mass618.679
Monoisotopic Mass618.24650
SMILESCCCCC/C=C/C=C/C(=O)OC1C(O)CC(c2ccc3c(c2O)C(=O)C2=C(C3=O)C3(O)C(=O)C=C(C)CC3(O)C=C2)OC1C
InChIInChI=1S/C35H38O10/c1-4-5-6-7-8-9-10-11-27(38)45-33-20(3)44-25(17-24(33)36)21-12-13-22-28(30(21)39)31(40)23-14-15-34(42)18-19(2)16-26(37)35(34,43)29(23)32(22)41/h8-16,20,24-25,33,36,39,42-43H,4-7,17-18H2,1-3H3/b9-8+,11-10+
InChIKeyMCNOFFKXBMHLAD-BNFZFUHLSA-N
Species of MetaboliteComponentSourceComments
Streptomyces (ncbitaxon:1883) - PubMed (3839783)
ChEBI Ontology
Outgoing Relation(s)
Capoamycin (CHEBI:222618) is a hydroxyanthraquinones (CHEBI:37485)
IUPAC Name 
[6-(4a,8,12b-trihydroxy-3-methyl-1,7,12-trioxo-4H-benzo[a]anthracen-9-yl)-4-hydroxy-2-methyloxan-3-yl] (2E,4E)-deca-2,4-dienoate
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4943238ChemSpider