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CHEBI:192981 - colleterpenol

ChEBI IDCHEBI:192981
ChEBI Namecolleterpenol
Stars
DefinitionA triterpenoid produced by Colletotrichum gloeosporioides colleterpenol synthase from all-trans-hexaprenyl diphosphate.
Last Modified20 November 2023
SubmitterTereza Calounova
DownloadsMolfile
FormulaC30H50O
Net Charge0
Average Mass426.729
Monoisotopic Mass426.38617
SMILESCC(C)=CCC/C(C)=C/CC[C@](C)(O)[C@H]1C/C=C(\C)CC/C=C(\C)CC/C=C(\C)CC1
InChIInChI=1S/C30H50O/c1-24(2)12-8-13-26(4)18-11-23-30(7,31)29-21-19-27(5)16-9-14-25(3)15-10-17-28(6)20-22-29/h12,14,17-19,29,31H,8-11,13,15-16,20-23H2,1-7H3/b25-14+,26-18+,27-19+,28-17+/t29-,30-/m0/s1
InChIKeyZVJDDUGYQUUMSZ-ACKQZMBFSA-N
ChEBI Ontology
Outgoing Relation(s)
colleterpenol (CHEBI:192981) is a macrocycle (CHEBI:51026)
colleterpenol (CHEBI:192981) is a olefinic compound (CHEBI:78840)
colleterpenol (CHEBI:192981) is a tertiary alcohol (CHEBI:26878)
colleterpenol (CHEBI:192981) is a triterpenoid (CHEBI:36615)
IUPAC Name 
(2S,5E)-6,10-dimethyl-2-[(1R,3E,7E,11E)-4,8,12-trimethylcyclotetradeca-3,7,11-trien-1-yl]undeca-5,9-dien-2-ol
UniProt Name  Source
colleterpenolUniProt
Manual XrefsDatabases
CPD-26706MetaCyc
Citations