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CHEBI:132903 - oplodiol

ChEBI IDCHEBI:132903
ChEBI Nameoplodiol
Stars
DefinitionA carbobicyclic compound that is 1,2,3,4,4a,5,8,8a-octahydronaphthalene which is substituted by hydroxy groups at positions 1 and 4, an isoopropyl group at position 7, and by methyl groups at positions 1 and 4a (the 1S,4R,4aR,8aR isomer). A sesquiterpenoid plant metabolite.
Last Modified7 September 2017
Submitterliuqingping
DownloadsMolfile
FormulaC15H26O2
Net Charge0
Average Mass238.371
Monoisotopic Mass238.19328
SMILES[H][C@@]12CC(C(C)C)=CC[C@@]1(C)[C@H](O)CC[C@]2(C)O
InChIInChI=1S/C15H26O2/c1-10(2)11-5-7-14(3)12(9-11)15(4,17)8-6-13(14)16/h5,10,12-13,16-17H,6-9H2,1-4H3/t12-,13-,14-,15+/m1/s1
InChIKeySOZSXJHFVBBAOY-TUVASFSCSA-N
Species of MetaboliteComponentSourceComments
Chimonanthus praecox (ncbitaxon:13419)
fruit (BTO:0000486) Article (Phytochem Lett., 2011, 4(3), 271-274)
leaf (BTO:0000713) Article (Phytochem Lett., 2011, 4(3), 271-274)
Homalomena occulta (ncbitaxon:714477) rhizome (BTO:0001181) PubMed (18649899)
Magnolia biondii (ncbitaxon:86725) - PubMed (19370929) Found in buds
Chloranthus japonicus (ncbitaxon:13007) whole plant (BTO:0001461) DOI (http://dx.doi.org/10.1016/j.phytol.2016.01.005)
Illicium oligandrum (ncbitaxon:145286) root (BTO:0001188) PubMed (25966312)
Renealmia thyrsoidea (ncbitaxon:199659) leaf (BTO:0000713) PubMed (25251262)
Hedychium spicatum (ncbitaxon:110723) rhizome (BTO:0001181) PubMed (23422227)
Artemisia japonica (ncbitaxon:223868) aerial part (BTO:0001658) PubMed (11440075)
Renealmia cincinnata (ncbitaxon:376570) fruit (BTO:0000486) PubMed (10643672)
Homalomena aromatica (ncbitaxon:1804071) root (BTO:0001188) PubMed (1368861)
Roles Classification
Biological Role:
plant metabolite  Any eukaryotic metabolite produced during a metabolic reaction in plants, the kingdom that include flowering plants, conifers and other gymnosperms.
ChEBI Ontology
Outgoing Relation(s)
oplodiol (CHEBI:132903) has role plant metabolite (CHEBI:76924)
oplodiol (CHEBI:132903) is a carbobicyclic compound (CHEBI:36785)
oplodiol (CHEBI:132903) is a octahydronaphthalenes (CHEBI:138397)
oplodiol (CHEBI:132903) is a secondary alcohol (CHEBI:35681)
oplodiol (CHEBI:132903) is a sesquiterpenoid (CHEBI:26658)
oplodiol (CHEBI:132903) is a tertiary alcohol (CHEBI:26878)
IUPAC Name 
(1S,4R,4aR,8aR)-7-isopropyl-1,4a-dimethyl-1,2,3,4,4a,5,8,8a-octahydronaphthalene-1,4-diol
Synonyms  Source
(−)-oplodiolKNApSAcK
[1S-(1α,4α,4aα,8aβ)]-1,2,3,4,4a,5,8,8a-octahydro-1,4a-dimethyl-7-(1-methylethyl)-1,4-naphthalenediolKNApSAcK
Manual XrefsDatabases
C00012788KNApSAcK
Registry NumbersSources
Reaxys:2106358Reaxys
CAS:13902-62-0ChemIDplus
Citations