CHEBI:218136 - Ganoleucoin Z

ChEBI IDCHEBI:218136
ChEBI NameGanoleucoin Z
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC38H52O13
Net Charge0
Average Mass716.821
Monoisotopic Mass716.34079
SMILESCC(=O)O[C@@H]1C(=O)C2=C(C(=O)C[C@H]3[C@@](C)(COC(=O)C[C@@](C)(O)CC(=O)O)[C@@H](O)CC[C@]23C)[C@]2(C)C(=O)C[C@H]([C@H](C)CCC=C(C)C(=O)O)[C@@]12C
InChIInChI=1S/C38H52O13/c1-19(10-9-11-20(2)33(47)48)22-14-26(42)38(8)29-23(40)15-24-35(5,30(29)31(46)32(37(22,38)7)51-21(3)39)13-12-25(41)36(24,6)18-50-28(45)17-34(4,49)16-27(43)44/h11,19,22,24-25,32,41,49H,9-10,12-18H2,1-8H3,(H,43,44)(H,47,48)/t19-,22-,24-,25+,32-,34+,35+,36-,37+,38+/m1/s1
InChIKeyAUIMRAJEISHKMP-IIYFVGFCSA-N
Species of MetaboliteComponentSourceComments
Ganoderma leucocontextum (ncbitaxon:1566825) - PubMed (30145334)
ChEBI Ontology
Outgoing Relation(s)
Ganoleucoin Z (CHEBI:218136) is a triterpenoid (CHEBI:36615)
IUPAC Name 
(6R)-6-[(3S,4S,5R,10S,12S,13R,14R,17R)-12-acetyloxy-4-[[(3S)-4-carboxy-3-hydroxy-3-methylbutanoyl]oxymethyl]-3-hydroxy-4,10,13,14-tetramethyl-7,11,15-trioxo-1,2,3,5,6,12,16,17-octahydrocyclopenta[a]phenanthren-17-yl]-2-methylhept-2-enoic acid