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

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L-gulonate

	Properties	Image
MNX_ID	MNXM1927
reference	chebi:13115
formula	C₆H₁₁O₇
global charge	-1
mol weight	195.147
InChIKey	RGHNJXZEOKUKBD-QTBDOELSSA-M
InChI	InChI=1S/C6H12O7/c7-1-2(8)3(9)4(10)5(11)6(12)13/h2-5,7-11H,1H2,(H,12,13)/p-1/t2-,3+,4-,5-/m0/s1
SMILES	O=C([O-])[C@@H](O)[C@@H](O)[C@H](O)[C@@H](O)CO

MNX internals

InChI (mnx)	InChI=1/C6H12O7/c7-1-2(8)3(9)4(10)5(11)6(12)13/h2-5,7-11H,1H2,(H,12,13)/t2-,3+,4-,5-/m0/s1
SMILES (mnx)	[CH2:1]([C@@H:2]([C@H:3]([C@@H:4]([C@@H:5]([C:6](=[O:12])[OH:13])[OH:11])[OH:10])[OH:9])[OH:8])[OH:7]

Parent-child relations graph

Occurences in reactions	#reac
in my sandbox	0
in MNXref (generic)	14
in models (compartimentalized)	11

Similar chemical compounds in external resources
Identifier	Description
reactome:R-ALL-5661268 reactomeM:R-ALL-5661268 CHEBI:13115 chebi:13115 RGHNJXZEOKUKBD-QTBDOELSSA-M	L-gulonate Gulonate L-Gulonate
sabiork.compound:26258 sabiorkM:26258 RGHNJXZEOKUKBD-QTBDOELSSA-M	Gulonate Gulonic acid
seed.compound:cpd00594 seedM:cpd00594 RGHNJXZEOKUKBD-QTBDOELSSA-M	Gulonate Gulonic acid L-Gulonate L-Gulonic acid L-gulonate gulonate
kegg.compound:C00800 keggC:C00800 RGHNJXZEOKUKBD-QTBDOELSSA-N	L-Gulonate Gulonate Gulonic acid L-Gulonic acid
sabiork.compound:2159 sabiorkM:2159 RGHNJXZEOKUKBD-QTBDOELSSA-M	L-Gulonate L-Gulonic acid
bigg.metabolite:guln__L biggM:guln__L	L-gulonate
vmhM:guln vmhmetabolite:guln RGHNJXZEOKUKBD-QTBDOELSSA-M	L-gulonate (2R,3R,4S,5R)-2,3,4,5,6-pentahydroxyhexanoic acid
metacyc.compound:L-GULONATE metacycM:L-GULONATE RGHNJXZEOKUKBD-QTBDOELSSA-M	L-gulonate gulonate
CHEBI:16154 chebi:16154 RGHNJXZEOKUKBD-QTBDOELSSA-N	L-gulonic acid Gulonic acid L-Gulonic acid
CHEBI:24461 chebi:24461	gulonate
CHEBI:24462 chebi:24462	gulonic acid
chebi:21318 chebi:21319 chebi:6235 biggM:M_guln__L keggC:M_C00800 seedM:M_cpd00594 vmhM:M_guln	secondary/obsolete/fantasy identifier