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CHEBI:215210 - (24E)-7alpha,26-dihydroxy-3-oxolanosta-8,24-diene

Default Structure
ChEBI IDCHEBI:215210
ChEBI Name(24E)-7alpha,26-dihydroxy-3-oxolanosta-8,24-diene
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC30H48O3
Net Charge0
Average Mass456.711
Monoisotopic Mass456.36035
SMILESC/C(=C\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]1C[C@H]3O)CO
InChIInChI=1S/C30H48O3/c1-19(18-31)9-8-10-20(2)21-11-16-30(7)26-22(12-15-29(21,30)6)28(5)14-13-25(33)27(3,4)24(28)17-23(26)32/h9,20-21,23-24,31-32H,8,10-18H2,1-7H3/b19-9+/t20-,21-,23-,24+,28-,29-,30+/m1/s1
InChIKeyAPHBNMHOVUYMRU-VSMNUCEVSA-N
Species of MetaboliteComponentSourceComments
Ganoderma casuarinicola (ncbitaxon:2057914) - PubMed (31855780)
ChEBI Ontology
Outgoing Relation(s)
(24E)-7alpha,26-dihydroxy-3-oxolanosta-8,24-diene (CHEBI:215210) is a triterpenoid (CHEBI:36615)
IUPAC Name 
(5R,7R,10S,13R,14R,17R)-7-hydroxy-17-[(E,2R)-7-hydroxy-6-methylhept-5-en-2-yl]-4,4,10,13,14-pentamethyl-1,2,5,6,7,11,12,15,16,17-decahydrocyclopenta[a]phenanthren-3-one