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2,3-dihydroxy-p-cumate

Properties

Image

Occurences in reactions

MNX_ID

MNXM2316

	#reac
in my sandbox	0
in MNXref (generic)	3
in models (compartimentalized)	0

formula

C₁₀H₁₁O₄

charge

-1

mass

195.06628

reference

InChIKey

ZHDLAGPONFNQMZ-UHFFFAOYSA-M

InChI

InChI=1S/C10H12O4/c1-5(2)6-3-4-7(10(13)14)9(12)8(6)11/h3-5,11-12H,1-2H3,(H,13,14)/p-1

SMILES

CC(C)c1ccc(C(=O)[O-])c(O)c1O

Parent-child relations graph

Deprecated MNXref IDs graph

Similar chemical compounds in external resources
Identifier	Description
CHEBI:36647 chebi:36647	2,3-dihydroxy-p-cumate 2,3-dihydroxy-4-(1-methylethyl)benzoate 2,3-dihydroxy-4-(propan-2-yl)benzoate 2,3-dihydroxy-4-isopropylbenzoate 4-isopropyl-o-pyrocatechuate
envipath:...41eb07539a8f envipathM:...41eb07539a8f kegg.compound:C06580 keggC:C06580	2,3-Dihydroxy-p-cumate
seed.compound:cpd03987 seedM:cpd03987	2,3-Dihydroxy-p-cumate 2,3-dihydroxy-4-(1-methylethyl)-benzoic acid 2,3-dihydroxy-p-cumate 4-isopropyl-o-pyrocatechuic acid
metacyc.compound:CPD-1006 metacycM:CPD-1006	2,3-dihydroxy-p-cumate 2,3-dihydroxy-4-(1-methylethyl)-benzoic acid 4-isopropyl-o-pyrocatechuic acid
CHEBI:16725 chebi:16725	2,3-dihydroxy-p-cumic acid 2,3-Dihydroxy-p-cumate 2,3-dihydroxy-4-(1-methylethyl)benzoic acid 2,3-dihydroxy-4-(propan-2-yl)benzoic acid 2,3-dihydroxy-4-isopropylbenzoic acid 4-isopropyl-o-pyrocatechuic acid
chebi:11425 chebi:19318 chebi:884 keggC:M_C06580 seedM:M_cpd03987	secondary/obsolete/fantasy identifier