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CHEBI:175722 - Ganoderic acid U

Default Structure
ChEBI IDCHEBI:175722
ChEBI NameGanoderic acid U
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SubmitterMetaboLights
DownloadsMolfile
FormulaC30H48O4
Net Charge0
Average Mass472.710
Monoisotopic Mass472.35526
SMILES[H][C@@]12C[C@@H](O)C3=C(CC[C@@]4(C)[C@@]3(C)CC[C@]4([H])[C@H](C)CC/C=C(\C)C(=O)O)[C@@]1(C)CC[C@@H](O)C2(C)C
InChIInChI=1S/C30H48O4/c1-18(9-8-10-19(2)26(33)34)20-11-16-30(7)25-21(12-15-29(20,30)6)28(5)14-13-24(32)27(3,4)23(28)17-22(25)31/h10,18,20,22-24,31-32H,8-9,11-17H2,1-7H3,(H,33,34)/b19-10+/t18-,20-,22-,23+,24-,28-,29-,30+/m1/s1
InChIKeyQHLHTTNIUVMWRY-BMGHSXGVSA-N
ChEBI Ontology
Outgoing Relation(s)
Ganoderic acid U (CHEBI:175722) is a triterpenoid (CHEBI:36615)
IUPAC Name 
(E,6R)-6-[(3R,5R,7R,10S,13R,14R,17R)-3,7-dihydroxy-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
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