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CL 312622

PropertiesImage
MNX_IDMNXM1137738 Image of MNXM1137738
referenceenvipathM:...5ed10af3e83e
formulaC14H15N3O5
global charge0
mol weight305.29
InChIKeyZRPVTLGVORAGCY-UHFFFAOYSA-N
InChIInChI=1S/C14H15N3O5/c1-6(2)14(3)13(22)16-10(17-14)9-8(12(20)21)4-7(5-15-9)11(18)19/h4-6H,1-3H3,(H,18,19)(H,20,21)(H,16,17,22)
SMILESCC(C)C1(C)N=C(C2=NC=C(C(=O)O)C=C2C(=O)O)NC1=O
MNX internals
InChI (mnx)InChI=1/C14H15N3O5/c1-6(2)14(3)13(22)16-10(17-14)9-8(12(20)21)4-7(5-15-9)11(18)19/h4-6H,1-3H3,(H,18,19)(H,20,21)(H,16,17,22)/t14? Image of MNXM1137738
SMILES (mnx)[CH3:1][CH:6]([CH3:2])[C:14]1([CH3:3])[C:13](=[O:22])[N:16]=[C:10]([C:9]2=[C:8]([C:12](=[O:20])[OH:21])[CH:4]=[C:7]([C:11](=[O:18])[OH:19])[CH:5]=[N:15]2)[NH:17]1
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:...5ed10af3e83e
envipathM:...5ed10af3e83e
ZRPVTLGVORAGCY-UHFFFAOYSA-N 		CL 312622