| Properties | Image |
| MNX_ID | MNXM157156 |
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| reference | chebi:73576 |
| formula | C15H27N3O6 |
| global charge | 0 |
| mol weight | 345.396 |
| InChIKey | CGHXMODRYJISSK-NHCYSSNCSA-N |
| InChI | InChI=1S/C15H27N3O6/c1-7(2)5-9(16)13(21)18-12(8(3)4)14(22)17-10(15(23)24)6-11(19)20/h7-10,12H,5-6,16H2,1-4H3,(H,17,22)(H,18,21)(H,19,20)(H,23,24)/t9-,10-,12-/m0/s1 |
| SMILES | CC(C)C[C@H](N)C(=O)N[C@H](C(=O)N[C@@H](CC(=O)O)C(=O)O)C(C)C |
MNX internals
| InChI (mnx) | InChI=1/C15H27N3O6/c1-7(2)5-9(16)13(21)18-12(8(3)4)14(22)17-10(15(23)24)6-11(19)20/h7-10,12H,5-6,16H2,1-4H3,(H,17,22)(H,18,21)(H,19,20)(H,23,24)/t9-,10-,12-/m0/s1 |
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| SMILES (mnx) | [CH3:1][CH:7]([CH3:2])[CH2:5][C@@H:9]([C:13](=[N:18][C@@H:12]([CH:8]([CH3:3])[CH3:4])[C:14](=[N:17][C@@H:10]([CH2:6][C:11](=[O:19])[OH:20])[C:15](=[O:23])[OH:24])[OH:22])[OH:21])[NH2:16] |
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