(2R)-2-[(1R)-4-methylcyclohex-3-en-1-yl]propanoic acid (CHEBI:141292)

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CHEBI:141292 - (2R)-2-[(1R)-4-methylcyclohex-3-en-1-yl]propanoic acid

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ChEBI ID	CHEBI:141292
ChEBI Name	(2R)-2-[(1R)-4-methylcyclohex-3-en-1-yl]propanoic acid
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ASCII Name	(2R)-2-[(1R)-4-methylcyclohex-3-en-1-yl]propanoic acid
Definition	A monocarboxylic acid that is propionic acid which is substituted at position 2 by a 4-methylcyclohex-3-en-1-yl group (the R,R stereoisomer). A secondary metabolite with antifungal activity obtained from the endophytic fungus Pestalotiopsis foedan, obtained from the branch of the upriver orange mangrove, Bruguiera sexangula.
Last Modified	2 November 2018
Submitter	R. Stephan
Downloads	Molfile

Formula	C10H16O2
Net Charge	0
Average Mass	168.236
Monoisotopic Mass	168.11503
SMILES	CC1=CC[C@H]([C@@H](C)C(=O)O)CC1
InChI	InChI=1S/C10H16O2/c1-7-3-5-9(6-4-7)8(2)10(11)12/h3,8-9H,4-6H2,1-2H3,(H,11,12)/t8-,9+/m1/s1
InChIKey	QOGOGJNRMJOCKH-BDAKNGLRSA-N

Species of Metabolite	Component	Source	Comments
Neopestalotiopsis foedans (ncbitaxon:290095)	-	PubMed (27448166)	Obtained from the branch of Bruguiera sexangula

Roles Classification

Chemical Role:	Bronsted acid A molecular entity capable of donating a hydron to an acceptor (Brønsted base).
Biological Roles:	fungal metabolite Any eukaryotic metabolite produced during a metabolic reaction in fungi, the kingdom that includes microorganisms such as the yeasts and moulds. antifungal agent An antimicrobial agent that destroys fungi by suppressing their ability to grow or reproduce.

ChEBI Ontology

Outgoing Relation(s)
	(2R)-2-[(1R)-4-methylcyclohex-3-en-1-yl]propanoic acid (CHEBI:141292) has role antifungal agent (CHEBI:35718)
	(2R)-2-[(1R)-4-methylcyclohex-3-en-1-yl]propanoic acid (CHEBI:141292) has role fungal metabolite (CHEBI:76946)
	(2R)-2-[(1R)-4-methylcyclohex-3-en-1-yl]propanoic acid (CHEBI:141292) is a monocarboxylic acid (CHEBI:25384)
	(2R)-2-[(1R)-4-methylcyclohex-3-en-1-yl]propanoic acid (CHEBI:141292) is a monoterpenoid (CHEBI:25409)

IUPAC Name
(2R)-2-[(1R)-4-methylcyclohex-3-en-1-yl]propanoic acid

Synonyms	Source
(2R)-2-[(1R)-4-methylcyclohex-3-en-1-yl]propionic acid	IUPAC
(+)-(4R,8R)-Δ¹-p-menthen-9-carboxylic acid	ChEBI

Registry Numbers	Sources
Reaxys:7014122	Reaxys

Citations