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compound 0228031

PropertiesImage
MNX_IDMNXM1170246 Image of MNXM1170246
referenceenvipathM:...f8daf362fb9c
formulaC11H15N2O6
global charge-1
mol weight271.249
InChIKeyVSAPCPJMTGCGDG-UHFFFAOYSA-M
InChIInChI=1S/C11H16N2O6/c1-6(14)8(9(16)5-13-7(2)15)3-12-4-10(17)11(18)19/h3,9,12,16H,4-5H2,1-2H3,(H,13,15)(H,18,19)/p-1
SMILESCC(=O)NCC(O)C(=CNCC(=O)C(=O)[O-])C(C)=O
MNX internals
InChI (mnx)InChI=1/C11H16N2O6/c1-6(14)8(9(16)5-13-7(2)15)3-12-4-10(17)11(18)19/h3,9,12,16H,4-5H2,1-2H3,(H,13,15)(H,18,19)/b8-3?/t9? Image of MNXM1170246
SMILES (mnx)[CH3:1][C:6]([C:8](=[CH:3][NH:12][CH2:4][C:10]([C:11]([OH:18])=[O:19])=[O:17])[CH:9]([CH2:5][N:13]=[C:7]([CH3:2])[OH:15])[OH:16])=[O:14]
Parent-child relations graph
Occurences in reactions#reac
in my sandbox 0
in MNXref (generic)0
in models (compartimentalized) 0
Similar chemical compounds in external resources
IdentifierDescription

envipath:...f8daf362fb9c
envipathM:...f8daf362fb9c
VSAPCPJMTGCGDG-UHFFFAOYSA-M
compound 0228031