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CHEBI:203293 - 16alpha,26-dihydroxylanosta-8,24-dien-3-one

Default Structure
ChEBI IDCHEBI:203293
ChEBI Name16alpha,26-dihydroxylanosta-8,24-dien-3-one
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC30H48O3
Net Charge0
Average Mass456.711
Monoisotopic Mass456.36035
SMILESCC(=CCC[C@@H](C)[C@H]1[C@H](O)C[C@@]2(C)C3=C(CC[C@]12C)[C@@]1(C)CCC(=O)C(C)(C)[C@@H]1CC3)CO
InChIInChI=1S/C30H48O3/c1-19(18-31)9-8-10-20(2)26-23(32)17-30(7)22-11-12-24-27(3,4)25(33)14-15-28(24,5)21(22)13-16-29(26,30)6/h9,20,23-24,26,31-32H,8,10-18H2,1-7H3/t20-,23-,24+,26+,28-,29-,30+/m1/s1
InChIKeyBXYMDRLMMWHQPT-UHTZFNSYSA-N
Species of MetaboliteComponentSourceComments
Ganoderma (ncbitaxon:5314) - PubMed (23909866)
ChEBI Ontology
Outgoing Relation(s)
16alpha,26-dihydroxylanosta-8,24-dien-3-one (CHEBI:203293) is a triterpenoid (CHEBI:36615)
IUPAC Name 
(5R,10S,13R,14R,16R,17R)-16-hydroxy-17-[(2R)-7-hydroxy-6-methylhept-5-en-2-yl]-4,4,10,13,14-pentamethyl-1,2,5,6,7,11,12,15,16,17-decahydrocyclopenta[a]phenanthren-3-one
Manual XrefsDatabases
78440938ChemSpider