| Properties | Image |
| MNX_ID | MNXM1121162 |
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| reference | chebi:158549 |
| formula | C12H21N3O5 |
| global charge | 0 |
| mol weight | 287.316 |
| InChIKey | QOIGKCBMXUCDQU-KDXUFGMBSA-N |
| InChI | InChI=1S/C12H21N3O5/c1-6(13)10(17)14-9(7(2)16)11(18)15-5-3-4-8(15)12(19)20/h6-9,16H,3-5,13H2,1-2H3,(H,14,17)(H,19,20)/t6-,7+,8+,9-/m0/s1 |
| SMILES | C[C@H](N)C(=O)N[C@H](C(=O)N1CCC[C@@H]1C(=O)O)[C@@H](C)O |
MNX internals
| InChI (mnx) | InChI=1/C12H21N3O5/c1-6(13)10(17)14-9(7(2)16)11(18)15-5-3-4-8(15)12(19)20/h6-9,16H,3-5,13H2,1-2H3,(H,14,17)(H,19,20)/t6-,7+,8+,9-/m0/s1 |
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| SMILES (mnx) | [CH3:1][C@@H:6]([C:10](=[N:14][C@@H:9]([C@@H:7]([CH3:2])[OH:16])[C:11]([N:15]1[CH2:5][CH2:3][CH2:4][C@@H:8]1[C:12](=[O:19])[OH:20])=[O:18])[OH:17])[NH2:13] |
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