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CHEBI:225227 - Ganoweberianic acid G

Default Structure
ChEBI IDCHEBI:225227
ChEBI NameGanoweberianic acid G
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC30H44O8
Net Charge0
Average Mass532.674
Monoisotopic Mass532.30362
SMILESC[C@H](CC(=O)C[C@H](C)C(=O)O)[C@H]1C[C@@H](O)[C@@]2(C)C3=C(C(=O)C[C@]12C)[C@@]1(C)CC[C@H](O)C(C)(CO)[C@@H]1CC3=O
InChIInChI=1S/C30H44O8/c1-15(9-17(32)10-16(2)26(37)38)18-11-23(36)30(6)25-19(33)12-21-27(3,8-7-22(35)28(21,4)14-31)24(25)20(34)13-29(18,30)5/h15-16,18,21-23,31,35-36H,7-14H2,1-6H3,(H,37,38)/t15-,16+,18-,21-,22+,23-,27+,28?,29-,30+/m1/s1
InChIKeyALWSSMXRTBHCGF-JKJQBNRUSA-N
Species of MetaboliteComponentSourceComments
Ganoderma weberianum (ncbitaxon:34468) - PubMed (33107297)
ChEBI Ontology
Outgoing Relation(s)
Ganoweberianic acid G (CHEBI:225227) is a triterpenoid (CHEBI:36615)
IUPAC Name 
(2S,6R)-6-[(3S,5R,10S,13R,14R,15R,17R)-3,15-dihydroxy-4-(hydroxymethyl)-4,10,13,14-tetramethyl-7,11-dioxo-2,3,5,6,12,15,16,17-octahydro-1H-cyclopenta[a]phenanthren-17-yl]-2-methyl-4-oxoheptanoic acid