| Properties | Image |
| MNX_ID | MNXM1123639 |
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| reference | chebi:161041 |
| formula | C11H19N3O6 |
| global charge | 0 |
| mol weight | 289.288 |
| InChIKey | XWKPSMRPIKKDDU-RCOVLWMOSA-N |
| InChI | InChI=1S/C11H19N3O6/c1-5(2)9(11(20)13-4-8(17)18)14-10(19)6(12)3-7(15)16/h5-6,9H,3-4,12H2,1-2H3,(H,13,20)(H,14,19)(H,15,16)(H,17,18)/t6-,9-/m0/s1 |
| SMILES | CC(C)[C@H](NC(=O)[C@@H](N)CC(=O)O)C(=O)NCC(=O)O |
MNX internals
| InChI (mnx) | InChI=1/C11H19N3O6/c1-5(2)9(11(20)13-4-8(17)18)14-10(19)6(12)3-7(15)16/h5-6,9H,3-4,12H2,1-2H3,(H,13,20)(H,14,19)(H,15,16)(H,17,18)/t6-,9-/m0/s1 |
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| SMILES (mnx) | [CH3:1][CH:5]([CH3:2])[C@@H:9]([C:11](=[N:13][CH2:4][C:8](=[O:17])[OH:18])[OH:20])[N:14]=[C:10]([C@H:6]([CH2:3][C:7](=[O:15])[OH:16])[NH2:12])[OH:19] |
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