PDB CCD ID: | AL0 |
Number of entries in BioLiP: | 2 |
Chemical formula: | C3 H7 N3 O4 |
InChI: | InChI=1S/C3H7N3O4/c4-2(3(7)8)1-6(10)5-9/h2,10H,1,4H2,(H,7,8)/t2-/m0/s1 |
InChIKey: | MLFKVJCWGUZWNV-REOHCLBHSA-N |
SMILES: | Software | SMILES |
---|
ACDLabs 10.04 | O=C(O)C(N)CN(O)N=O | CACTVS 3.341 | N[C@@H](CN(O)N=O)C(O)=O | OpenEye OEToolkits 1.5.0 | C(C(C(=O)O)N)N(N=O)O | OpenEye OEToolkits 1.5.0 | C([C@@H](C(=O)O)N)N(N=O)O | CACTVS 3.341 | N[CH](CN(O)N=O)C(O)=O |
|
Name: | 3-[HYDROXY(NITROSO)AMINO]-L-ALANINE; L-ALANOSINE |
ChEMBL: | CHEMBL452715 |
DrugBank: | DB05540 |
ZINC: | ZINC000004214744 |