PDB CCD ID: | NZH |
Number of entries in BioLiP: | 0 |
Chemical formula: | C7 H9 N7 O |
InChI: | InChI=1S/C7H9N7O/c8-5(3-15)1-6-2-14(4-9-6)7-10-12-13-11-7/h2-5H,1,8H2,(H,10,11,12,13)/t5-/m0/s1 |
InChIKey: | OOFNCFXOGMDAEN-YFKPBYRVSA-N |
SMILES: | Software | SMILES |
---|
CACTVS 3.341 | N[CH](Cc1cn(cn1)c2[nH]nnn2)C=O | ACDLabs 10.04 | O=CC(N)Cc2ncn(c1nnnn1)c2 | CACTVS 3.341 | N[C@@H](Cc1cn(cn1)c2[nH]nnn2)C=O | OpenEye OEToolkits 1.5.0 | c1c(ncn1c2[nH]nnn2)C[C@@H](C=O)N | OpenEye OEToolkits 1.5.0 | c1c(ncn1c2[nH]nnn2)CC(C=O)N |
|
Name: | (2S)-2-AMINO-3-[1-(1H-TETRAAZOL-5-YL)-1H-IMIDAZOL-4-YL]PROPANAL; TETRAZOLYL HISTIDINE |
DrugBank: | DB02528 |
ZINC: | ZINC000058638991 |