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

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L-talonate

	Properties	Image
MNX_ID	MNXM168188
reference	metacycM:CPD-24869
formula	C₆H₁₁O₇
global charge	-1
mol weight	195.147
InChIKey	RGHNJXZEOKUKBD-NRXMZTRTSA-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)	1
in models (compartimentalized)	0

Similar chemical compounds in external resources
Identifier	Description
metacyc.compound:CPD-24869 metacycM:CPD-24869 RGHNJXZEOKUKBD-NRXMZTRTSA-M	L-talonate L-talonic acid
sabiork.compound:25030 sabiorkM:25030 RGHNJXZEOKUKBD-NRXMZTRTSA-M	L-Talonate (2R,3S,4R,5R)-2,3,4,5,6-pentahydroxyhexanoate