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(E)-3-(methoxycarbonyl)pent-2-enedioate

Properties

Image

Occurences in reactions

MNX_ID

MNXM735059

	#reac
in my sandbox	0
in MNXref (generic)	1
in models (compartimentalized)	2

formula

C₇H₆O₆

charge

-2

mass

186.01754

reference

InChIKey

BRYKYSQCLNCYQW-DUXPYHPUSA-L

InChI

InChI=1S/C7H8O6/c1-13-7(12)4(2-5(8)9)3-6(10)11/h2H,3H2,1H3,(H,8,9)(H,10,11)/p-2/b4-2+

SMILES

COC(=O)/C(=C/C(=O)[O-])CC(=O)[O-]

Parent-child relations graph

Deprecated MNXref IDs graph

Similar chemical compounds in external resources
Identifier	Description
CHEBI:57470 chebi:57470	(E)-3-(methoxycarbonyl)pent-2-enedioate (2E)-3-(methoxycarbonyl)pent-2-enedioate (2E)-3-(methoxycarbonyl)pent-2-enedioate dianion (2E)-3-(methoxycarbonyl)pent-2-enedioate(2-)
lipidmaps:LMFA07010698 lipidmapsM:LMFA07010698	(2E)-3-(methoxycarbonyl)pent-2-enedioic acid (2E)-3-(methoxycarbonyl)pent-2-enedioic acid O4 WE 7:3
CHEBI:15663 chebi:15663	(2E)-3-(methoxycarbonyl)pent-2-enedioic acid (E)-3-(Methoxycarbonyl)pent-2-enedioate
sabiork.compound:13579 sabiorkM:13579 kegg.compound:C11514 keggC:C11514	(E)-3-(Methoxycarbonyl)pent-2-enedioate
seed.compound:cpd08353 seedM:cpd08353	(E)-3-(Methoxycarbonyl)pent-2-enedioate (E)-3-(methoxycarbonyl)pent-2-enedioate E-3-carboxy-2-pentenedioate 6-methyl ester aconm monomethyl-ester-of-trans-aconitate
metacyc.compound:MONOMETHYL-ESTER-OF-TRANS-ACONITATE metacycM:MONOMETHYL-ESTER-OF-TRANS-ACONITATE	(E)-3-(methoxycarbonyl)pent-2-enedioate (E)-3-carboxy-2-pentenedioate 6-methyl ester
chebi:10951 chebi:277 keggC:M_C11514 seedM:M_cpd08353	secondary/obsolete/fantasy identifier