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CHEBI:223303 - 27-nor-3,7,24-trioxolanosta-8-ene

Default Structure
ChEBI IDCHEBI:223303
ChEBI Name27-nor-3,7,24-trioxolanosta-8-ene
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC29H44O3
Net Charge0
Average Mass440.668
Monoisotopic Mass440.32905
SMILESCCC(=O)CC[C@@H](C)[C@H]1CC[C@@]2(C)C3=C(CC[C@]12C)[C@@]1(C)CCC(=O)C(C)(C)[C@@H]1CC3=O
InChIInChI=1S/C29H44O3/c1-8-19(30)10-9-18(2)20-11-16-29(7)25-21(12-15-28(20,29)6)27(5)14-13-24(32)26(3,4)23(27)17-22(25)31/h18,20,23H,8-17H2,1-7H3/t18-,20-,23+,27-,28-,29+/m1/s1
InChIKeyWOOOVJXHIPCWAT-XBNZGPRQSA-N
Species of MetaboliteComponentSourceComments
Ganoderma (ncbitaxon:5314) - PubMed (32733078)
ChEBI Ontology
Outgoing Relation(s)
27-nor-3,7,24-trioxolanosta-8-ene (CHEBI:223303) is a triterpenoid (CHEBI:36615)
IUPAC Name 
(5R,10S,13R,14R,17R)-4,4,10,13,14-pentamethyl-17-[(2R)-5-oxoheptan-2-yl]-2,5,6,11,12,15,16,17-octahydro-1H-cyclopenta[a]phenanthrene-3,7-dione