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(2,2,3-trimethyl-5-oxocyclopent-3-en-1-yl)acetate

MNXM9395 is deprecated and here replaced by MNXM731570
!!! Alternative mappings exist !!!

Properties

Image

Occurences in reactions

MNX_ID

MNXM731570

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

formula

C₁₀H₁₃O₃

charge

-1

mass

181.08702

reference

InChIKey

UJJNLVMCZZZXFW-UHFFFAOYSA-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

SMILES

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

Parent-child relations graph

Deprecated MNXref IDs graph

Similar chemical compounds in external resources
Identifier	Description
CHEBI:19733 chebi:19733	(2,2,3-trimethyl-5-oxocyclopent-3-en-1-yl)acetate 2-Oxo-delta(3)-4,5,5-trimethylcyclopentenylacetate
CHEBI:28045 chebi:28045	(2,2,3-trimethyl-5-oxocyclopent-3-en-1-yl)acetic acid 2-Oxo-delta(3)-4,5,5-trimethylcyclopentenylacetic acid 2-Oxo-delta3-4,5,5-trimethylcyclopentenylacetic acid Otmcpa
kegg.compound:C07159 keggC:C07159	2-Oxo-Delta3-4,5,5-trimethylcyclopentenylacetate 2-Oxo-Delta3-4,5,5-trimethylcyclopentenylacetic acid
envipath:...f015c967f8e5 envipathM:...f015c967f8e5	2-Oxo-delta3-4,5,5-trimethylcyclopentenylacetate
chebi:1244 chebi:37436 keggC:M_C07159	secondary/obsolete/fantasy identifier