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CHEBI:212261 - Ganoderic acid Jc

Default Structure
ChEBI IDCHEBI:212261
ChEBI NameGanoderic acid Jc
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC30H44O5
Net Charge0
Average Mass484.677
Monoisotopic Mass484.31887
SMILESCC(=CC(O)C[C@@H](C)[C@H]1C[C@H](O)[C@@]2(C)C3=CCC4C(C)(C)C(=O)CC[C@]4(C)C3=CC[C@]12C)C(=O)O
InChIInChI=1S/C30H44O5/c1-17(14-19(31)15-18(2)26(34)35)22-16-25(33)30(7)21-8-9-23-27(3,4)24(32)11-12-28(23,5)20(21)10-13-29(22,30)6/h8,10,15,17,19,22-23,25,31,33H,9,11-14,16H2,1-7H3,(H,34,35)/t17-,19?,22-,23?,25+,28-,29-,30-/m1/s1
InChIKeyNUTLQKXDJNCAOL-WQBLBXPZSA-N
Species of MetaboliteComponentSourceComments
Ganoderma sinense (ncbitaxon:36075) - PubMed (22161763)
ChEBI Ontology
Outgoing Relation(s)
Ganoderic acid Jc (CHEBI:212261) is a triterpenoid (CHEBI:36615)
IUPAC Name 
(6R)-4-hydroxy-6-[(10S,13R,14R,15S,17R)-15-hydroxy-4,4,10,13,14-pentamethyl-3-oxo-1,2,5,6,12,15,16,17-octahydrocyclopenta[a]phenanthren-17-yl]-2-methylhept-2-enoic acid
Manual XrefsDatabases
78441112ChemSpider