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CHEBI:223339 - 24,25-epoxy-3-oxolanosta-7,9(11)-diene

Default Structure
ChEBI IDCHEBI:223339
ChEBI Name24,25-epoxy-3-oxolanosta-7,9(11)-diene
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC30H46O2
Net Charge0
Average Mass438.696
Monoisotopic Mass438.34978
SMILESC[C@H](CCC1OC1(C)C)[C@H]1CC[C@@]2(C)C3=CC[C@H]4C(C)(C)C(=O)CC[C@]4(C)C3=CC[C@]12C
InChIInChI=1S/C30H46O2/c1-19(9-12-25-27(4,5)32-25)20-13-17-30(8)22-10-11-23-26(2,3)24(31)15-16-28(23,6)21(22)14-18-29(20,30)7/h10,14,19-20,23,25H,9,11-13,15-18H2,1-8H3/t19-,20-,23+,25?,28-,29-,30+/m1/s1
InChIKeyQPJBHADMAAWADW-AMTITVGDSA-N
Species of MetaboliteComponentSourceComments
Ganoderma (ncbitaxon:5314) - PubMed (32733078)
ChEBI Ontology
Outgoing Relation(s)
24,25-epoxy-3-oxolanosta-7,9(11)-diene (CHEBI:223339) is a triterpenoid (CHEBI:36615)
IUPAC Name 
(5R,10S,13R,14R,17R)-17-[(2R)-4-(3,3-dimethyloxiran-2-yl)butan-2-yl]-4,4,10,13,14-pentamethyl-1,2,5,6,12,15,16,17-octahydrocyclopenta[a]phenanthren-3-one