| Properties | Image |
| MNX_ID | MNXM1121934 |
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| reference | chebi:159323 |
| formula | C17H31N3O4 |
| global charge | 0 |
| mol weight | 341.452 |
| InChIKey | XVZCXCTYGHPNEM-MELADBBJSA-N |
| InChI | InChI=1S/C17H31N3O4/c1-10(2)8-12(18)15(21)19-13(9-11(3)4)16(22)20-7-5-6-14(20)17(23)24/h10-14H,5-9,18H2,1-4H3,(H,19,21)(H,23,24)/t12-,13-,14+/m0/s1 |
| SMILES | CC(C)C[C@H](NC(=O)[C@@H](N)CC(C)C)C(=O)N1CCC[C@@H]1C(=O)O |
MNX internals
| InChI (mnx) | InChI=1/C17H31N3O4/c1-10(2)8-12(18)15(21)19-13(9-11(3)4)16(22)20-7-5-6-14(20)17(23)24/h10-14H,5-9,18H2,1-4H3,(H,19,21)(H,23,24)/t12-,13-,14+/m0/s1 |
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| SMILES (mnx) | [CH3:1][CH:10]([CH3:2])[CH2:8][C@@H:12]([C:15](=[N:19][C@@H:13]([CH2:9][CH:11]([CH3:3])[CH3:4])[C:16]([N:20]1[CH2:7][CH2:5][CH2:6][C@@H:14]1[C:17](=[O:23])[OH:24])=[O:22])[OH:21])[NH2:18] |
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