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CHEBI:63683 - (13E)-labda-7,13-dien-15-ol

ChEBI IDCHEBI:63683
ChEBI Name(13E)-labda-7,13-dien-15-ol
Stars
ASCII Name(13E)-labda-7,13-dien-15-ol
DefinitionA labdane diterpenoid in which the labdane skeleton has double bonds at C-7 and C-13 (the latter with E-stereochemistry) and carries a hydroxy group at the terminal C-15 atom.
Last Modified7 September 2017
SubmitterKristian Axelsen
DownloadsMolfile
FormulaC20H34O
Net Charge0
Average Mass290.491
Monoisotopic Mass290.26097
SMILES[H][C@]1(CC/C(C)=C/CO)C(C)=CC[C@@]2([H])C(C)(C)CCC[C@]12C
InChIInChI=1S/C20H34O/c1-15(11-14-21)7-9-17-16(2)8-10-18-19(3,4)12-6-13-20(17,18)5/h8,11,17-18,21H,6-7,9-10,12-14H2,1-5H3/b15-11+/t17-,18-,20+/m0/s1
InChIKeyKPOGKOXAZMFZNM-ATPOGHATSA-N
ChEBI Ontology
Outgoing Relation(s)
(13E)-labda-7,13-dien-15-ol (CHEBI:63683) is a labdane diterpenoid (CHEBI:36770)
(13E)-labda-7,13-dien-15-ol (CHEBI:63683) is a octahydronaphthalenes (CHEBI:138397)
(13E)-labda-7,13-dien-15-ol (CHEBI:63683) is a primary alcohol (CHEBI:15734)
IUPAC Names 
(13E)-labda-7,13-dien-15-ol
(2E)-3-methyl-5-[(1S,4aS,8aS)-2,5,5,8a-tetramethyl-1,4,4a,5,6,7,8,8a-octahydronaphthalen-1-yl]pent-2-en-1-ol
UniProt Name  Source
(13E)-labda-7,13-dien-15-olUniProt
Manual XrefsDatabases
CPD-13929MetaCyc
Citations