beta-maaliene (CHEBI:132831)

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ChEBI Name	β-maaliene

ChEBI ID	CHEBI:132831

ChEBI ASCII Name	beta-maaliene

Definition	A sesquiterpene that is 1a,2,3,3a,4,5,6,7b-octahydro-1H-cyclopropa[a]naphthalene carrying foru methyl substituents at positions 1, 1, 3a and 7.

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

Submitter	qingping liu

Supplier Information

Download	Molfile XML SDF

Formula

C15H24

Net Charge

Average Mass

204.352

Monoisotopic Mass

204.18780

InChI

InChI=1S/C15H24/c1-10-6-5-8-15(4)9-7-11-13(12(10)15)14(11,2)3/h11,13H,5-9H2,1-4H3/t11-,13-,15+/m1/s1

InChIKey

UPGLJTCDRBIZKP-KYOSRNDESA-N

SMILES

[C@@]12([C@](C1(C)C)(CC[C@]3(C2=C(CCC3)C)C)[H])[H]

Metabolite of Species	Details
Cyperus articulatus (NCBI:txid1352543)	Found in rhizome (BTO:0001181). See: DOI
Nardostachys chinensis (NCBI:txid179860)	Also known as Nardostachys jatamansi and Nardostachys grandiflora See: PubMed
Angelica dahurica (NCBI:txid48101)	Found in root (BTO:0001188). See: PubMed
Artemisia monosperma (NCBI:txid72348)	Found in leaf (BTO:0000713). See: PubMed
Artemisia monosperma (NCBI:txid72348)	Found in stem (BTO:0001300). See: PubMed

Roles Classification
Biological Role(s):	volatile oil component Any plant metabolite that is found naturally as a component of a volatile oil. 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	β-maaliene (CHEBI:132831) has role plant metabolite (CHEBI:76924) β-maaliene (CHEBI:132831) has role volatile oil component (CHEBI:27311) β-maaliene (CHEBI:132831) is a carbotricyclic compound (CHEBI:38032) β-maaliene (CHEBI:132831) is a polycyclic olefin (CHEBI:35714) β-maaliene (CHEBI:132831) is a sesquiterpene (CHEBI:35189)

IUPAC Name

(1aR,3aS,7bS)-1,1,3a,7-tetramethyl-1a,2,3,3a,4,5,6,7b-octahydro-1H-cyclopropa[a]naphthalene

Last Modified

31 August 2022