EMBL-EBI | Chemical Biology | ChEBI

Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search

CHEBI:219898 - 3beta,11alpha-dihydroxy-7-oxo-5alpha-lanost-8,24E-dien-26-ol

Default Structure
ChEBI IDCHEBI:219898
ChEBI Name3beta,11alpha-dihydroxy-7-oxo-5alpha-lanost-8,24E-dien-26-ol
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC30H48O4
Net Charge0
Average Mass472.710
Monoisotopic Mass472.35526
SMILESC/C(=C\CCC(C)[C@H]1CC[C@@]2(C)C3=C([C@H](O)C[C@]12C)[C@@]1(C)CC[C@H](O)C(C)(C)[C@@H]1CC3=O)CO
InChIInChI=1S/C30H48O4/c1-18(17-31)9-8-10-19(2)20-11-14-29(6)26-21(32)15-23-27(3,4)24(34)12-13-28(23,5)25(26)22(33)16-30(20,29)7/h9,19-20,22-24,31,33-34H,8,10-17H2,1-7H3/b18-9+/t19?,20-,22-,23+,24+,28+,29+,30-/m1/s1
InChIKeyIAYVIKGZPMCIGP-FMGHJBACSA-N
Species of MetaboliteComponentSourceComments
Ganoderma (ncbitaxon:5314) - PubMed (25457485)
ChEBI Ontology
Outgoing Relation(s)
3beta,11alpha-dihydroxy-7-oxo-5alpha-lanost-8,24E-dien-26-ol (CHEBI:219898) is a triterpenoid (CHEBI:36615)
IUPAC Name 
(3S,5R,10S,11R,13R,14R,17R)-3,11-dihydroxy-17-[(E)-7-hydroxy-6-methylhept-5-en-2-yl]-4,4,10,13,14-pentamethyl-1,2,3,5,6,11,12,15,16,17-decahydrocyclopenta[a]phenanthren-7-one
Manual XrefsDatabases
78442086ChemSpider