MetaNetX
Automated Model Construction and Genome Annotation for Large-Scale Metabolic Networks

Feedback

hexanedioate

	Properties	Image
MNX_ID	MNXM2800
reference	chebi:17128
formula	C₆H₈O₄
global charge	-2
mol weight	144.126
InChIKey	WNLRTRBMVRJNCN-UHFFFAOYSA-L
InChI	InChI=1S/C6H10O4/c7-5(8)3-1-2-4-6(9)10/h1-4H2,(H,7,8)(H,9,10)/p-2
SMILES	O=C([O-])CCCCC(=O)[O-]

MNX internals

InChI (mnx)	InChI=1/C6H10O4/c7-5(8)3-1-2-4-6(9)10/h1-4H2,(H,7,8)(H,9,10)
SMILES (mnx)	[CH2:1]([CH2:2][CH2:4][C:6](=[O:9])[OH:10])[CH2:3][C:5](=[O:7])[OH:8]

Parent-child relations graph

Occurences in reactions	#reac
in my sandbox	0
in MNXref (generic)	13
in models (compartimentalized)	8

Similar chemical compounds in external resources
Identifier	Description
CHEBI:17128 chebi:17128 WNLRTRBMVRJNCN-UHFFFAOYSA-L	hexanedioate O2C(CH2)4CO2 dianion adipate dianion adipate(2-) hexan-1,6-dicarboxylate hexanedioic acid, ion(2-)
envipath:...03317c15c763 envipathM:...03317c15c763 WNLRTRBMVRJNCN-UHFFFAOYSA-L	Adipate
sabiork.compound:2863 sabiorkM:2863 WNLRTRBMVRJNCN-UHFFFAOYSA-N	Adipate 1,6-Hexanedicarboxylic acid Adipic acid Hexan-1,6-dicarboxylate Hexanedioate
seed.compound:cpd03642 seedM:cpd03642 WNLRTRBMVRJNCN-UHFFFAOYSA-L	Adipate ADIPATE Adipic acid Hexan-1,6-dicarboxylate Hexanedioate adipate adipic acid hexanedioic acid
kegg.compound:C06104 keggC:C06104 WNLRTRBMVRJNCN-UHFFFAOYSA-N	Adipate Adipic acid Hexan-1,6-dicarboxylate Hexanedioate Hexanedioic acid
kegg.drug:D08839 keggD:D08839 WNLRTRBMVRJNCN-UHFFFAOYSA-N	Adipic acid (NF)
hmdb:HMDB0000448 WNLRTRBMVRJNCN-UHFFFAOYSA-N	Adipic acid 1,4-Butanedicarboxylate 1,4-Butanedicarboxylic acid 1,6-Hexanedioate 1,6-Hexanedioic acid Acifloctin Acinetten Adi-pure Adilactetten Adipate Adipic acid, MG salt (1:1) Adipic acid, calcium salt Adipic acid, cu salt Adipic acid, cu(+2) salt Adipic acid, cu(+2) salt (1:1) Adipic acid, diammonium salt Adipic acid, disodium salt Adipic acid, monoammonium salt Adipic acid, nickel salt Adipic acid, potassium salt Adipic acid, sodium salt Adipinate Adipinic acid Adipinsaeure Ammonium adipate Diammonium adipate Hexan-1,6-dicarboxylate Hexan-1,6-dicarboxylic acid Hexanedioate Hexanedioic acid INS no. 355 Kyselina adipova Magnesium adipate Molten adipate Molten adipic acid Sodium adipate adipic acid e 355 e-355 e355 hexanedioic acid
lipidmaps:LMFA01170048 lipidmapsM:LMFA01170048 WNLRTRBMVRJNCN-UHFFFAOYSA-N	Adipic acid FA 6:1 Hexanedioic acid O2
bigg.metabolite:adpac biggM:adpac WNLRTRBMVRJNCN-UHFFFAOYSA-L	Adipic acid hexane-1,6-dioic acid
SLM:000000720 slm:000000720 WNLRTRBMVRJNCN-UHFFFAOYSA-L	Hexanedioate
CHEBI:30833 chebi:30833 WNLRTRBMVRJNCN-UHFFFAOYSA-M	adipate(1-) 5-carboxypentanoate hexanedioic acid, conjugate base hydrogen adipate
metacyc.compound:ADIPATE metacycM:ADIPATE WNLRTRBMVRJNCN-UHFFFAOYSA-L	adipate 1,4-butanedicarboxylic acid adipic acid hexanedioic acid
CHEBI:30832 chebi:30832 WNLRTRBMVRJNCN-UHFFFAOYSA-N	adipic acid 1,4-butanedicarboxylic acid 1,6-hexanedioic acid Adipic acid Adipinsaeure E 355 E-355 E355 INS No. 355 adipinic acid hexanedioic acid
vmhM:adpac vmhmetabolite:adpac WNLRTRBMVRJNCN-UHFFFAOYSA-L	adipic acid hexanedioic acid
envipath:...489cf87c9e69 envipathM:...489cf87c9e69 WNLRTRBMVRJNCN-UHFFFAOYSA-L	compound 0042086
hmdb:HMDB0004862 hmdb:HMDB00448 hmdb:HMDB04862 chebi:13744 chebi:22264 chebi:22268 chebi:2489 biggM:M_adpac keggC:M_C06104 keggD:M_D08839 seedM:M_cpd03642 vmhM:M_adpac	secondary/obsolete/fantasy identifier