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[(1R)-2,2,3-trimethyl-2-oxocyclopent-3-en-1-yl]acetate

Properties

Image

Occurences in reactions

MNX_ID

MNXM731571

	#reac
in my sandbox	0
in MNXref (generic)	4
in models (compartimentalized)	0

formula

C₁₀H₁₃O₃

charge

-1

mass

181.08702

reference

InChIKey

UJJNLVMCZZZXFW-ZETCQYMHSA-M

InChI

InChI=1S/C10H14O3/c1-6-4-8(11)7(5-9(12)13)10(6,2)3/h4,7H,5H2,1-3H3,(H,12,13)/p-1/t7-/m0/s1

SMILES

CC1=CC(=O)[C@H](CC(=O)[O-])C1(C)C

Parent-child relations graph

Deprecated MNXref IDs graph

Similar chemical compounds in external resources
Identifier	Description
CHEBI:64815 chebi:64815	[(1R)-2,2,3-trimethyl-2-oxocyclopent-3-en-1-yl]acetate [(1R)-2,2,3-trimethyl-5-oxocyclopent-3-en-1-yl]acetate [(R)-2,2,3-trimethyl-2-oxocyclopent-3-en-1-yl]acetate
seed.compound:cpd04415 seedM:cpd04415	2-Oxo-delta3-4,5,5-trimethylcyclopentenylacetate 2-Oxo-delta3-4,5,5-trimethylcyclopentenylacetic acid 2-oxo-delta3-4,5,5-trimethylcyclopentenylacetate [(1R)-2,2,3-Trimethyl-5-oxocyclopent-3-enyl]acetate [(1R)-4,5,5-trimethyl-2-oxocyclopent-3-enyl]acetate
kegg.compound:C20271 keggC:C20271	[(1R)-2,2,3-Trimethyl-5-oxocyclopent-3-enyl]acetate
metacyc.compound:CPD-866 metacycM:CPD-866	[(1R)-4,5,5-trimethyl-2-oxocyclopent-3-enyl]acetate 2-oxo-Delta3-4,5,5-trimethylcyclopentenylacetate
CHEBI:64817 chebi:64817	[(R)-2,2,3-trimethyl-5-oxocyclopent-3-en-1-yl]acetic acid [(1R)-2,2,3-trimethyl-5-oxocyclopent-3-en-1-yl]acetic acid
keggC:M_C20271 seedM:M_cpd04415	secondary/obsolete/fantasy identifier