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2-Isopropylmaleate

MNXM1706 is deprecated and here replaced by MNXM1368660
!!! Alternative mappings exist !!!
PropertiesImage
MNX_IDMNXM1368660 Image of MNXM1368660
referencebiggM:2ippm
formulaC7H8O4
global charge-2
mol weight156.137
InChIKeyNJMGRJLQRLFQQX-UHFFFAOYSA-L
InChIInChI=1S/C7H10O4/c1-4(2)5(7(10)11)3-6(8)9/h3-4H,1-2H3,(H,8,9)(H,10,11)/p-2
SMILESCC(C)C(=CC(=O)[O-])C(=O)[O-]
MNX internals
InChI (mnx)InChI=1/C7H10O4/c1-4(2)5(7(10)11)3-6(8)9/h3-4H,1-2H3,(H,8,9)(H,10,11)/b5-3? Image of MNXM1368660
SMILES (mnx)[CH3:1][CH:4]([CH3:2])[C:5](=[CH:3][C:6](=[O:8])[OH:9])[C:7](=[O:10])[OH:11]
Parent-child relations graph
Occurences in reactions#reac
in my sandbox 0
in MNXref (generic)2
in models (compartimentalized) 2
Similar chemical compounds in external resources
IdentifierDescription

bigg.metabolite:2ippm
biggM:2ippm
NJMGRJLQRLFQQX-UHFFFAOYSA-L 		2-Isopropylmaleate

biggM:M_2ippm 		secondary/obsolete/fantasy identifier