| PDB CCD ID: | I4O |
| Number of entries in BioLiP: | 0 |
| Chemical formula: | C6 H8 N3 O6 V |
| InChI: | InChI=1S/C6H9N3O2.4O.V/c7-5(6(10)11)1-4-2-8-3-9-4;;;;;/h2-3,5H,1,7H2,(H2,8,9,10,11);;;;;/q;;3*-1;+1/p-1/t5-;;;;;/m0...../s1 |
| InChIKey: | MEHUMAARUKETGW-HNJBGNBTSA-M |
| SMILES: | | Software | SMILES |
|---|
| CACTVS 3.385 | N[CH](Cc1cn(cn1)[V]([O-])([O-])([O-])=O)C(O)=O | | OpenEye OEToolkits 2.0.7 | c1c(ncn1[V](=O)([O-])([O-])[O-])C[C@@H](C(=O)O)N | | OpenEye OEToolkits 2.0.7 | c1c(ncn1[V](=O)([O-])([O-])[O-])CC(C(=O)O)N | | CACTVS 3.385 | N[C@@H](Cc1cn(cn1)[V]([O-])([O-])([O-])=O)C(O)=O |
|
| Name: | Histidine oxo-vanadium complex;
[4-[(2S)-2-azanyl-3-oxidanyl-3-oxidanylidene-propyl]imidazol-1-yl]-tris(oxidanidyl)-oxidanylidene-vanadium |
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