7-epi-alpha-eudesmol (CHEBI:138040)

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ChEBI Name	*7-epi-α-eudesmol*

ChEBI ID	CHEBI:138040

ChEBI ASCII Name	7-epi-alpha-eudesmol

Definition	A eudesmane sesquiterpenoid in which the eudesmane skeleton carries a hydroxy substituent at C-11 and has a double bond between C-3 and C-4.

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

Submitter	Kristian Axelsen

Supplier Information

Download	Molfile XML SDF

Formula

C15H26O

Net Charge

Average Mass

222.367

Monoisotopic Mass

222.19837

InChI

InChI=1S/C15H26O/c1-11-6-5-8-15(4)9-7-12(10-13(11)15)14(2,3)16/h6,12-13,16H,5,7-10H2,1-4H3/t12-,13-,15+/m0/s1

InChIKey

FCSRUSQUAVXUKK-KCQAQPDRSA-N

SMILES

C1CC=C([C@]2([C@]1(CC[C@@H](C2)C(C)(C)O)C)[H])C

Metabolite of Species	Details
Cymbopogon distans (NCBI:txid152208)	Found in leaf (BTO:0000713). Isolated from the leaf oil See: DOI
Callicarpa americana (NCBI:txid204211)	Isolated from the essential oil 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. volatile oil component Any plant metabolite that is found naturally as a component of a volatile oil.

ChEBI Ontology
Outgoing	7-epi-α-eudesmol (CHEBI:138040) has role plant metabolite (CHEBI:76924) 7-epi-α-eudesmol (CHEBI:138040) has role volatile oil component (CHEBI:27311) 7-epi-α-eudesmol (CHEBI:138040) is a eudesmane sesquiterpenoid (CHEBI:62508) 7-epi-α-eudesmol (CHEBI:138040) is a octahydronaphthalenes (CHEBI:138397) 7-epi-α-eudesmol (CHEBI:138040) is a tertiary alcohol (CHEBI:26878)

IUPAC Name

2-[(2S,4aR,8aR)-4a,8-dimethyl-1,2,3,4,4a,5,6,8a-octahydronaphthalen-2-yl]propan-2-ol

Synonyms	Sources
7-epi-alpha-Eudesmol	KNApSAcK
7-epi-α-eudesmol	UniProt
[2S-(2alpha,4abeta,8aalpha)]-1,2,3,4,4a,5,6,8a-Octahydro-alpha,alpha,4a,8-tetramethyl-2-naphthalenemethanol	KNApSAcK

Last Modified

12 October 2017