EMBL-EBI | Chemical Biology | ChEBI

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

CHEBI:175438 - Camelliol A

ChEBI IDCHEBI:175438
ChEBI NameCamelliol A
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC30H50O
Net Charge0
Average Mass426.729
Monoisotopic Mass426.38617
SMILES[H][C@@]12CC(C)(C)CC[C@]1(C)CCC(C)=C2CC/C=C(\C)CC[C@@H]1C(C)=CC[C@H](O)C1(C)C
InChIInChI=1S/C30H50O/c1-21(12-14-25-23(3)13-15-27(31)29(25,6)7)10-9-11-24-22(2)16-17-30(8)19-18-28(4,5)20-26(24)30/h10,13,25-27,31H,9,11-12,14-20H2,1-8H3/b21-10+/t25-,26+,27+,30+/m1/s1
InChIKeyHRQSDUTTZIHWJQ-FEHKDBFISA-N
ChEBI Ontology
Outgoing Relation(s)
Camelliol A (CHEBI:175438) is a sesquiterpenoid (CHEBI:26658)
IUPAC Name 
(1S,5R)-5-[(E)-6-[(4aR,8aR)-2,4a,7,7-tetramethyl-3,4,5,6,8,8a-hexahydronaphthalen-1-yl]-3-methylhex-3-enyl]-4,6,6-trimethylcyclohex-3-en-1-ol
Manual XrefsDatabases
4953617ChemSpider
Registry NumbersSources
CAS:220359-69-3ChemIDplus