| PDB CCD ID: | M64 |
| Number of entries in BioLiP: | 0 |
| Chemical formula: | C10 H18 N2 O3 |
| InChI: | InChI=1S/C10H18N2O3/c1-7-4-2-3-5-12(7)9(13)6-8(11)10(14)15/h7-8H,2-6,11H2,1H3,(H,14,15)/t7-,8-/m0/s1 |
| InChIKey: | QRGCQWGDUNCKGH-YUMQZZPRSA-N |
| SMILES: | | Software | SMILES |
|---|
| OpenEye OEToolkits 2.0.7 | C[C@H]1CCCCN1C(=O)C[C@@H](C(=O)O)N | | OpenEye OEToolkits 2.0.7 | CC1CCCCN1C(=O)CC(C(=O)O)N | | CACTVS 3.385 | C[C@H]1CCCCN1C(=O)C[C@H](N)C(O)=O | | CACTVS 3.385 | C[CH]1CCCCN1C(=O)C[CH](N)C(O)=O | | ACDLabs 12.01 | C1CCN(C(C)C1)C(CC(C(=O)O)N)=O |
|
| Name: | (2S)-2-amino-4-[(2S)-2-methylpiperidin-1-yl]-4-oxobutanoic acid |
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