oplodiol (CHEBI:132903)

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ChEBI Name	oplodiol

ChEBI ID	CHEBI:132903

Definition	A 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.

Stars	This entity has been manually annotated by the ChEBI Team.

Submitter	qingping liu

Supplier Information

Download	Molfile XML SDF

Formula

C15H26O2

Net Charge

Average Mass

238.366

Monoisotopic Mass

238.19328

InChI

InChI=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

InChIKey

SOZSXJHFVBBAOY-TUVASFSCSA-N

SMILES

[C@@]12([C@@H](CC[C@@]([C@@]1(CC(=CC2)C(C)C)[H])(O)C)O)C

Metabolite of Species	Details
Hedychium sp.catum (NCBI:txid110723)	Found in rhizome (BTO:0001181). See: PubMed
Chloranthus japonicus (NCBI:txid13007)	Found in whole plant (BTO:0001461). See: DOI
Chimonanthus praecox (NCBI:txid13419)	Found in fruit (BTO:0000486). See: Phytochem Lett., 2011, 4(3), 271-274
Chimonanthus praecox (NCBI:txid13419)	Found in leaf (BTO:0000713). See: Phytochem Lett., 2011, 4(3), 271-274
Illicium oligandrum (NCBI:txid145286)	Found in root (BTO:0001188). See: PubMed
Homalomena aromatica (NCBI:txid1804071)	Found in root (BTO:0001188). See: PubMed
Renealmia thyrsoidea (NCBI:txid199659)	Found in leaf (BTO:0000713). See: PubMed
Artemisia japonica (NCBI:txid223868)	Found in aerial part (BTO:0001658). See: PubMed
Renealmia cincinnata (NCBI:txid376570)	Found in fruit (BTO:0000486). See: PubMed
Homalomena occulta (NCBI:txid714477)	Found in rhizome (BTO:0001181). See: PubMed
Magnolia biondii (NCBI:txid86725)	Found in buds See: PubMed

Roles Classification
Biological Role(s):	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	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	Sources
(−)-oplodiol	KNApSAcK
[1S-(1α,4α,4aα,8aβ)]-1,2,3,4,4a,5,8,8a-octahydro-1,4a-dimethyl-7-(1-methylethyl)-1,4-naphthalenediol	KNApSAcK

Last Modified

07 September 2017