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CHEBI:175451 - 3-Epimoretenol

Default Structure
ChEBI IDCHEBI:175451
ChEBI Name3-Epimoretenol
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC30H50O
Net Charge0
Average Mass426.729
Monoisotopic Mass426.38617
SMILESC=C(C)C1CCC2(C)C1CCC1(C)C2CCC2C3(C)CCC(O)C(C)(C)C3CCC21C
InChIInChI=1S/C30H50O/c1-19(2)20-11-15-27(5)21(20)12-17-29(7)23(27)9-10-24-28(6)16-14-25(31)26(3,4)22(28)13-18-30(24,29)8/h20-25,31H,1,9-18H2,2-8H3
InChIKeyLFPVZIIPFONRSW-UHFFFAOYSA-N
ChEBI Ontology
Outgoing Relation(s)
3-Epimoretenol (CHEBI:175451) is a hopanoid (CHEBI:51963)
IUPAC Name 
5a,5b,8,8,11a,13b-hexamethyl-3-prop-1-en-2-yl-1,2,3,3a,4,5,6,7,7a,9,10,11,11b,12,13,13a-hexadecahydrocyclopenta[a]chrysen-9-ol
Manual XrefsDatabases
525874ChemSpider
HMDB0035123HMDB