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compound 0109087

PropertiesImage
MNX_IDMNXM1197155 Image of MNXM1197155
referenceenvipathM:...b8c75da303ab
formulaC11H15N2O7
global charge-1
mol weight287.248
InChIKeyMPPIDTPXFQYOQU-YIXHJXPBSA-M
InChIInChI=1S/C11H16N2O7/c1-3-12-8(16)4-13-11(20,7(15)5-14)6(2)9(17)10(18)19/h4-6,8,12,16,20H,3H2,1-2H3,(H,18,19)/p-1/b13-4+
SMILESCCNC(O)/C=N/C(O)(C(=O)C=O)C(C)C(=O)C(=O)[O-]
MNX internals
InChI (mnx)InChI=1/C11H16N2O7/c1-3-12-8(16)4-13-11(20,7(15)5-14)6(2)9(17)10(18)19/h4-6,8,12,16,20H,3H2,1-2H3,(H,18,19)/b13-4+/t6?,8?,11? Image of MNXM1197155
SMILES (mnx)[CH3:1][CH2:3][NH:12][CH:8](/[CH:4]=[N:13]/[C:11]([CH:6]([CH3:2])[C:9]([C:10]([OH:18])=[O:19])=[O:17])([C:7]([CH:5]=[O:14])=[O:15])[OH:20])[OH:16]
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:...b8c75da303ab
envipathM:...b8c75da303ab
MPPIDTPXFQYOQU-YIXHJXPBSA-M
compound 0109087