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(2R,3S)-2,3-dimethylmalate

MNXM9755 is deprecated and here replaced by MNXM1108563
!!! Alternative mappings exist !!!
PropertiesImage
MNX_IDMNXM1108563 Image of MNXM1108563
referencechebi:57422
formulaC6H8O5
global charge-2
mol weight160.125
InChIKeyWTIIULQJLZEHGZ-AWFVSMACSA-L
InChIInChI=1S/C6H10O5/c1-3(4(7)8)6(2,11)5(9)10/h3,11H,1-2H3,(H,7,8)(H,9,10)/p-2/t3-,6-/m1/s1
SMILESC[C@H](C(=O)[O-])[C@@](C)(O)C(=O)[O-]
MNX internals
InChI (mnx)InChI=1/C6H10O5/c1-3(4(7)8)6(2,11)5(9)10/h3,11H,1-2H3,(H,7,8)(H,9,10)/t3-,6-/m1/s1 Image of MNXM1108563
SMILES (mnx)[CH3:1][C@H:3]([C:4](=[O:7])[OH:8])[C@:6]([CH3:2])([C:5](=[O:9])[OH:10])[OH:11]
Parent-child relations graph
Occurences in reactions#reac
in my sandbox 0
in MNXref (generic)2
in models (compartimentalized) 0
Similar chemical compounds in external resources
IdentifierDescription

CHEBI:57422
chebi:57422
WTIIULQJLZEHGZ-AWFVSMACSA-L 		(2R,3S)-2,3-dimethylmalate
(2R,3S)-2,3-dimethylmalate(2-)
(2R,3S)-2-hydroxy-2,3-dimethylbutanedioate
(2R,3S)-2-hydroxy-2,3-dimethylsuccinate

CHEBI:15582
chebi:15582
WTIIULQJLZEHGZ-AWFVSMACSA-N 		(2R,3S)-2,3-dimethylmalic acid
(2R,3S)-2,3-Dimethylmalate
(2R,3S)-2,3-dimethylmalate
(2R,3S)-2-hydroxy-2,3-dimethylbutanedioic acid

chebi:10857
chebi:183
chebi:18543 		secondary/obsolete/fantasy identifier