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CHEBI:208766 - 3alpha-acetyloxylanosta-8,24-diene-21-OL

Default Structure
ChEBI IDCHEBI:208766
ChEBI Name3alpha-acetyloxylanosta-8,24-diene-21-OL
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC32H52O3
Net Charge0
Average Mass484.765
Monoisotopic Mass484.39165
SMILESCC(=O)O[C@@H]1CC[C@]2(C)C3=C(CCC2C1(C)C)[C@]1(C)CC[C@H]([C@H](CO)CCC=C(C)C)[C@@]1(C)CC3
InChIInChI=1S/C32H52O3/c1-21(2)10-9-11-23(20-33)24-14-18-32(8)26-12-13-27-29(4,5)28(35-22(3)34)16-17-30(27,6)25(26)15-19-31(24,32)7/h10,23-24,27-28,33H,9,11-20H2,1-8H3/t23-,24+,27?,28+,30+,31+,32-/m0/s1
InChIKeyHARWQRYVMOWQIV-MUHWKEAKSA-N
Species of MetaboliteComponentSourceComments
Fomitopsis pinicola (ncbitaxon:40483) - PubMed (17487610)
ChEBI Ontology
Outgoing Relation(s)
3alpha-acetyloxylanosta-8,24-diene-21-OL (CHEBI:208766) is a triterpenoid (CHEBI:36615)
IUPAC Name 
[(3R,10S,13R,14R,17R)-17-[(2R)-1-hydroxy-6-methylhept-5-en-2-yl]-4,4,10,13,14-pentamethyl-2,3,5,6,7,11,12,15,16,17-decahydro-1H-cyclopenta[a]phenanthren-3-yl] acetate
Manual XrefsDatabases
78438457ChemSpider