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CHEBI:207374 - (24E)-3beta-acetoxy-15alpha-hydroxy-7-oxolanosta-8,24-dien-26-oicacid

Default Structure
ChEBI IDCHEBI:207374
ChEBI Name(24E)-3beta-acetoxy-15alpha-hydroxy-7-oxolanosta-8,24-dien-26-oicacid
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC32H48O6
Net Charge0
Average Mass528.730
Monoisotopic Mass528.34509
SMILESCC(=O)O[C@H]1CC[C@]2(C)C3=C(C(=O)C[C@H]2C1(C)C)[C@]1(C)[C@@H](O)C[C@H]([C@H](C)CC/C=C(\C)C(=O)O)[C@@]1(C)CC3
InChIInChI=1S/C32H48O6/c1-18(10-9-11-19(2)28(36)37)22-16-25(35)32(8)27-21(12-15-31(22,32)7)30(6)14-13-26(38-20(3)33)29(4,5)24(30)17-23(27)34/h11,18,22,24-26,35H,9-10,12-17H2,1-8H3,(H,36,37)/b19-11+/t18-,22-,24+,25+,26+,30-,31-,32+/m1/s1
InChIKeyKXSRWTNYHOCSFB-TVURBSCFSA-N
Species of MetaboliteComponentSourceComments
Ganodermaspecies (ncbitaxon:1869158) - PubMed (28504879)
ChEBI Ontology
Outgoing Relation(s)
(24E)-3beta-acetoxy-15alpha-hydroxy-7-oxolanosta-8,24-dien-26-oicacid (CHEBI:207374) is a triterpenoid (CHEBI:36615)
IUPAC Name 
(E,6R)-6-[(3S,5R,10S,13R,14R,15S,17R)-3-acetyloxy-15-hydroxy-4,4,10,13,14-pentamethyl-7-oxo-1,2,3,5,6,11,12,15,16,17-decahydrocyclopenta[a]phenanthren-17-yl]-2-methylhept-2-enoic acid
Manual XrefsDatabases
78438946ChemSpider