CHEBI:215242 - Monascuskaodione

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This entity has been annotated by a third party. If you would like more information added to this entry, please contact ChEBI via email or GitHub.
ChEBI Name Monascuskaodione
ChEBI ID CHEBI:215242
Stars This entity has been manually annotated by a third party.
Submitter MetaboLights
Supplier Information
Download Molfile XML SDF
Formula C24H30O5
Net Charge 0
Average Mass 398.499
Monoisotopic Mass 398.20932
InChI InChI=1S/C24H30O5/c1-4-6-7-8-9-10-12-19(25)21-22-18-15-28-17(11-5-2)13-16(18)14-20(26)24(22,3)29-23(21)27/h5,11,13-15,21-22H,4,6-10,12H2,1-3H3/b11-5+/t21-,22-,24+/m1/s1
InChIKey MGXIYWIJISLRMT-AVVHGWNQSA-N
SMILES O=C1C=C2C(=COC(=C2)/C=C/C)[C@H]3[C@]1(OC(=O)[C@@H]3C(=O)CCCCCCCC)C
Metabolite of Species Details
Monascus kaoliang (NCBI:txid180403) See: DOI
ChEBI Ontology
Outgoing Monascuskaodione (CHEBI:215242) is a cyclohexenones (CHEBI:48953)
IUPAC Name
(6aR,9S,9aS)-6a-methyl-9-nonanoyl-3-[(E)-prop-1-enyl]-9,9a-dihydrouro[2,3-h]isochromene-6,8-dione
Manual Xref Database
78441528 ChemSpider
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