| Properties | Image |
| MNX_ID | MNXM1123662 |
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| reference | chebi:161064 |
| formula | C14H25N3O6 |
| global charge | 0 |
| mol weight | 331.369 |
| InChIKey | ZUNMTUPRQMWMHX-LSJOCFKGSA-N |
| InChI | InChI=1S/C14H25N3O6/c1-6(2)10(16-12(20)8(15)5-9(18)19)13(21)17-11(7(3)4)14(22)23/h6-8,10-11H,5,15H2,1-4H3,(H,16,20)(H,17,21)(H,18,19)(H,22,23)/t8-,10-,11-/m0/s1 |
| SMILES | CC(C)[C@H](NC(=O)[C@@H](NC(=O)[C@@H](N)CC(=O)O)C(C)C)C(=O)O |
MNX internals
| InChI (mnx) | InChI=1/C14H25N3O6/c1-6(2)10(16-12(20)8(15)5-9(18)19)13(21)17-11(7(3)4)14(22)23/h6-8,10-11H,5,15H2,1-4H3,(H,16,20)(H,17,21)(H,18,19)(H,22,23)/t8-,10-,11-/m0/s1 |
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| SMILES (mnx) | [CH3:1][CH:6]([CH3:2])[C@@H:10]([C:13](=[N:17][C@@H:11]([CH:7]([CH3:3])[CH3:4])[C:14](=[O:22])[OH:23])[OH:21])[N:16]=[C:12]([C@H:8]([CH2:5][C:9](=[O:18])[OH:19])[NH2:15])[OH:20] |
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