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heptanedioate

Properties

Image

Occurences in reactions

MNX_ID

MNXM2555

	#reac
in my sandbox	0
in MNXref (generic)	3
in models (compartimentalized)	5

formula

C₇H₁₀O₄

charge

-2

mass

158.05901

reference

InChIKey

WLJVNTCWHIRURA-UHFFFAOYSA-L

InChI

InChI=1S/C7H12O4/c8-6(9)4-2-1-3-5-7(10)11/h1-5H2,(H,8,9)(H,10,11)/p-2

SMILES

O=C([O-])CCCCCC(=O)[O-]

Parent-child relations graph

Deprecated MNXref IDs graph

Similar chemical compounds in external resources
Identifier	Description
CHEBI:36165 chebi:36165	heptanedioate pimelate(2-)
bigg.metabolite:pime biggM:pime	Pimelate
seed.compound:cpd01727 seedM:cpd01727	Pimelate 6-Carboxyhexanoate 6-carboxyhexanoate Heptanedioic acid Pimelic acid heptanedioate pime pimelate pimelic acid
kegg.compound:C02656 keggC:C02656	Pimelate 6-Carboxyhexanoate Heptanedioic acid Pimelic acid
hmdb:HMDB0000857	Pimelic acid 1,5-Pentanedicarboxylate 1,5-Pentanedicarboxylic acid 1,7-Heptanedioate 1,7-Heptanedioic acid 6-Carboxyhexanoate 6-Carboxyhexanoic acid Acid, pimelic Acids, pimelic Heptandioate Heptandioic acid Heptane-1,7-dioate Heptane-1,7-dioic acid Heptanedioate Heptanedioic acid Pilerate Pileric acid Pimelate Pimelic acids heptanedioic acid pimelic acid
lipidmaps:LMFA01170051 lipidmapsM:LMFA01170051	Pimelic acid FA 7:1 Heptanedioic acid O2
CHEBI:17774 chebi:17774	pimelate(1-) 6-carboxyhexanoate Pimelate heptanedioate hydrogen pimelate
metacyc.compound:CPD-205 metacycM:CPD-205	pimelate 6-carboxyhexanoate heptanedioate pimelic acid
CHEBI:133773 chebi:133773	pimelate heptanedioic acid anion heptanedioic acid anions pimelates pimelic acid anion pimelic acid anions
CHEBI:30531 chebi:30531	pimelic acid 1,5-pentanedicarboxylic acid 6-carboxyhexanoic acid Heptanedioic acid PIMELIC ACID Pimelate Pimelic acid heptanedioic acid
hmdb:HMDB00857 chebi:12209 chebi:20708 chebi:20709 chebi:2175 chebi:24517 chebi:44980 biggM:M_pime keggC:M_C02656 seedM:M_cpd01727	secondary/obsolete/fantasy identifier