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CHEBI:203974 - 3b,15a-Diacetoxylanosta-8,24-dien-26-oic acid

Default Structure
ChEBI IDCHEBI:203974
ChEBI Name3b,15a-Diacetoxylanosta-8,24-dien-26-oic acid
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC34H52O6
Net Charge0
Average Mass556.784
Monoisotopic Mass556.37639
SMILESCC(=O)O[C@H]1CC[C@]2(C)C3=C(CCC2C1(C)C)[C@]1(C)[C@@H](OC(C)=O)C[C@H](C(C)CC/C=C(\C)C(=O)O)[C@@]1(C)CC3
InChIInChI=1S/C34H52O6/c1-20(11-10-12-21(2)30(37)38)26-19-29(40-23(4)36)34(9)25-13-14-27-31(5,6)28(39-22(3)35)16-17-32(27,7)24(25)15-18-33(26,34)8/h12,20,26-29H,10-11,13-19H2,1-9H3,(H,37,38)/b21-12+/t20?,26-,27?,28+,29+,32-,33-,34-/m1/s1
InChIKeyFFHZCNIREJAVOS-UTAGODHDSA-N
Species of MetaboliteComponentSourceComments
Ganoderma lucidum (ncbitaxon:5315) - PubMed (21401205)
ChEBI Ontology
Outgoing Relation(s)
3b,15a-Diacetoxylanosta-8,24-dien-26-oic acid (CHEBI:203974) is a triterpenoid (CHEBI:36615)
IUPAC Name 
(E)-6-[(3S,10S,13R,14R,15S,17R)-3,15-diacetyloxy-4,4,10,13,14-pentamethyl-2,3,5,6,7,11,12,15,16,17-decahydro-1H-cyclopenta[a]phenanthren-17-yl]-2-methylhept-2-enoic acid
Manual XrefsDatabases
78439671ChemSpider