CHEBI:172745 - Hericenone C

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ChEBI Name Hericenone C
ChEBI ID CHEBI:172745
Stars This entity has been manually annotated by a third party.
Submitter MetaboLights
Supplier Information
Download Molfile XML SDF
Formula C35H54O6
Net Charge 0
Average Mass 570.811
Monoisotopic Mass 570.39204
InChI InChI=1S/C35H54O6/c1-6-7-8-9-10-11-12-13-14-15-16-17-18-19-34(38)41-26-29-24-33(40-5)31(35(39)32(29)25-36)21-20-28(4)23-30(37)22-27(2)3/h20,22,24-25,39H,6-19,21,23,26H2,1-5H3/b28-20+
InChIKey OGYBKWUOLWCQDS-VFCFBJKWSA-N
SMILES O(C(=O)CCCCCCCCCCCCCCC)CC=1C(=C(O)C(=C(OC)C1)C/C=C(/CC(=O)C=C(C)C)\C)C=O
Metabolite of Species Details
Homo sapiens (NCBI:txid9606) Found in blood plasma (BTO:0000131). See: MetaboLights Study
ChEBI Ontology
Outgoing Hericenone C (CHEBI:172745) is a monoterpenoid (CHEBI:25409)
IUPAC Name
[4-[(2E)-3,7-dimethyl-5-oxoocta-2,6-dienyl]-2-ormyl-3-hydroxy-5-methoxyphenyl]methyl hexadecanoate
Manual Xrefs Databases
30777327 ChemSpider
HMDB0039138 HMDB
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