CHEBI:215307 - 26,27-dihydroxy-24,25-epoxylanosta-7,9(11)-dien-3-one

ChEBI IDCHEBI:215307
ChEBI Name26,27-dihydroxy-24,25-epoxylanosta-7,9(11)-dien-3-one
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC30H46O4
Net Charge0
Average Mass470.694
Monoisotopic Mass470.33961
SMILESC[C@H](CCC1OC1(CO)CO)[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/C30H46O4/c1-19(7-10-25-30(17-31,18-32)34-25)20-11-15-29(6)22-8-9-23-26(2,3)24(33)13-14-27(23,4)21(22)12-16-28(20,29)5/h8,12,19-20,23,25,31-32H,7,9-11,13-18H2,1-6H3/t19-,20-,23+,25?,27-,28-,29+/m1/s1
InChIKeyMLISLCWVLNEVOC-XBYMQVEYSA-N
Species of MetaboliteComponentSourceComments
Ganoderma lucidum (ncbitaxon:5315) - PubMed (32062196)
ChEBI Ontology
Outgoing Relation(s)
26,27-dihydroxy-24,25-epoxylanosta-7,9(11)-dien-3-one (CHEBI:215307) is a triterpenoid (CHEBI:36615)
IUPAC Name 
(5R,10S,13R,14R,17R)-17-[(2R)-4-[3,3-bis(hydroxymethyl)oxiran-2-yl]butan-2-yl]-4,4,10,13,14-pentamethyl-1,2,5,6,12,15,16,17-octahydrocyclopenta[a]phenanthren-3-one