CHEBI:197867 - (6Z)-9'-apo-rhodoxanthinone

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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 (6Z)-9'-apo-rhodoxanthinone
ChEBI ID CHEBI:197867
Stars This entity has been manually annotated by a third party.
Submitter MetaboLights
Supplier Information
Download Molfile XML SDF
Formula C29H36O2
Net Charge 0
Average Mass 416.605
Monoisotopic Mass 416.27153
InChI InChI=1S/C29H36O2/c1-22(12-8-9-13-23(2)16-11-17-26(5)30)14-10-15-24(3)18-19-28-25(4)20-27(31)21-29(28,6)7/h8-20H,21H2,1-7H3/b12-8+,13-9+,15-10+,17-11+,22-14+,23-16+,24-18+,28-19+
InChIKey ICIRHPDWFNPSHC-UQAGTHSRSA-N
SMILES O=C1C=C(\C(=C/C=C(/C=C/C=C(/C=C/C=C/C(=C/C=C/C(=O)C)/C)\C)\C)\C(C1)(C)C)C
Metabolite of Species Details
Escherichia coli (NCBI:txid562) See: DOI
ChEBI Ontology
Outgoing (6Z)-9'-apo-rhodoxanthinone (CHEBI:197867) is a sesterterpenoid (CHEBI:26660)
IUPAC Name
(4Z)-3,5,5-trimethyl-4-[(2E,4E,6E,8E,10E,12E,14E)-3,7,12-trimethyl-16-oxoheptadeca-2,4,6,8,10,12,14-heptaenylidene]cyclohex-2-en-1-one
Manual Xref Database
78434605 ChemSpider
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