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CHEBI:81371 - Simiarenol

Default Structure
ChEBI IDCHEBI:81371
ChEBI NameSimiarenol
Stars
DownloadsMolfile
FormulaC30H50O
Net Charge0
Average Mass426.729
Monoisotopic Mass426.38617
SMILES[H][C@@]12CC[C@H](C(C)C)[C@@]1(C)CC[C@]1(C)[C@@]3([H])CC=C4C(C)(C)[C@@H](O)CC[C@@]4([H])[C@]3(C)CC[C@@]21C
InChIInChI=1S/C30H50O/c1-19(2)20-9-12-23-27(20,5)15-17-30(8)24-13-10-21-22(11-14-25(31)26(21,3)4)28(24,6)16-18-29(23,30)7/h10,19-20,22-25,31H,9,11-18H2,1-8H3/t20-,22-,23-,24+,25+,27-,28+,29+,30-/m1/s1
InChIKeyXVXPXUMUGATHPD-JMJRLLIOSA-N
ChEBI Ontology
Outgoing Relation(s)
Simiarenol (CHEBI:81371) is a triterpenoid (CHEBI:36615)
Manual XrefsDatabases
C17901KEGG COMPOUND
Registry NumbersSources
CAS:1615-94-7KEGG COMPOUND