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CHEBI:175453 - Dammaradienol

Default Structure
ChEBI IDCHEBI:175453
ChEBI NameDammaradienol
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC30H50O
Net Charge0
Average Mass426.729
Monoisotopic Mass426.38617
SMILES[H][C@]12CC[C@]3([H])[C@@H](C(=C)CCC=C(C)C)CC[C@@]3(C)[C@]1(C)CC[C@@]1([H])C(C)(C)[C@@H](O)CC[C@]21C
InChIInChI=1S/C30H50O/c1-20(2)10-9-11-21(3)22-14-18-29(7)23(22)12-13-25-28(6)17-16-26(31)27(4,5)24(28)15-19-30(25,29)8/h10,22-26,31H,3,9,11-19H2,1-2,4-8H3/t22-,23-,24+,25-,26+,28+,29-,30-/m1/s1
InChIKeyWZAMDSBJONFHAO-WJQSYXMBSA-N
ChEBI Ontology
Outgoing Relation(s)
Dammaradienol (CHEBI:175453) is a triterpenoid (CHEBI:36615)
IUPAC Name 
(3S,5R,8R,9R,10R,13R,14R,17S)-4,4,8,10,14-pentamethyl-17-(6-methylhepta-1,5-dien-2-yl)-2,3,5,6,7,9,11,12,13,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-3-ol
Manual XrefsDatabases
20119990ChemSpider
Registry NumbersSources
CAS:52914-32-6ChemIDplus