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CHEBI:216738 - Lepiotaprocerin J

Default Structure
ChEBI IDCHEBI:216738
ChEBI NameLepiotaprocerin J
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC33H46O6
Net Charge0
Average Mass538.725
Monoisotopic Mass538.32944
SMILESCOC(=O)C(C)=CCC[C@@H](C)[C@H]1[C@@H](OC(C)=O)C[C@@]2(C)C3=C(C(=O)C[C@]12C)[C@@]1(C)C=CC(=O)C(C)(C)[C@@H]1CC3
InChIInChI=1S/C33H46O6/c1-19(11-10-12-20(2)29(37)38-9)27-24(39-21(3)34)18-32(7)22-13-14-25-30(4,5)26(36)15-16-31(25,6)28(22)23(35)17-33(27,32)8/h12,15-16,19,24-25,27H,10-11,13-14,17-18H2,1-9H3/t19-,24+,25+,27+,31+,32+,33-/m1/s1
InChIKeyQIBKWBBUQXWZDO-YOOSDHQBSA-N
Species of MetaboliteComponentSourceComments
Macrolepiota procera (ncbitaxon:56183) - PubMed (29510036)
ChEBI Ontology
Outgoing Relation(s)
Lepiotaprocerin J (CHEBI:216738) is a triterpenoid (CHEBI:36615)
IUPAC Name 
methyl (6R)-6-[(5R,10S,13R,14R,16S,17R)-16-acetyloxy-4,4,10,13,14-pentamethyl-3,11-dioxo-6,7,12,15,16,17-hexahydro-5H-cyclopenta[a]phenanthren-17-yl]-2-methylhept-2-enoate