PDB CCD ID: | 1HB |
Number of entries in BioLiP: | 0 |
Chemical formula: | C7 H16 N2 O2 |
InChI: | InChI=1S/C7H16N2O2/c1-9(2)7(11)4-3-6(8)5-10/h6,10H,3-5,8H2,1-2H3/t6-/m0/s1 |
InChIKey: | MLUJTSZAHCOXIF-LURJTMIESA-N |
SMILES: | Software | SMILES |
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CACTVS 3.370 | CN(C)C(=O)CC[C@H](N)CO | OpenEye OEToolkits 1.7.6 | CN(C)C(=O)CC[C@@H](CO)N | CACTVS 3.370 | CN(C)C(=O)CC[CH](N)CO | ACDLabs 12.01 | O=C(N(C)C)CCC(N)CO | OpenEye OEToolkits 1.7.6 | CN(C)C(=O)CCC(CO)N |
|
Name: | (4S)-4-amino-5-hydroxy-N,N-dimethylpentanamide; N,N-dimethyl-L-glutamine aldehyde, bound form |
ZINC: | ZINC000039147585 |