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CHEBI:172745 - Hericenone C

ChEBI IDCHEBI:172745
ChEBI NameHericenone C
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC35H54O6
Net Charge0
Average Mass570.811
Monoisotopic Mass570.39204
SMILESCCCCCCCCCCCCCCCC(=O)OCc1cc(OC)c(C/C=C(\C)CC(=O)C=C(C)C)c(O)c1C=O
InChIInChI=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+
InChIKeyOGYBKWUOLWCQDS-VFCFBJKWSA-N
Species of MetaboliteComponentSourceComments
Homo sapiens (ncbitaxon:9606) blood plasma (BTO:0000131) MetaboLights (MTBLS2633)
ChEBI Ontology
Outgoing Relation(s)
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 XrefsDatabases
HMDB0039138HMDB
30777327ChemSpider