| Properties | Image |
| MNX_ID | MNXM1122677 |
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| reference | chebi:160071 |
| formula | C17H32N4O6 |
| global charge | 0 |
| mol weight | 388.465 |
| InChIKey | SKRGVGLIRUGANF-AVGNSLFASA-N |
| InChI | InChI=1S/C17H32N4O6/c1-10(2)9-13(21-15(24)11(19)5-3-4-8-18)16(25)20-12(17(26)27)6-7-14(22)23/h10-13H,3-9,18-19H2,1-2H3,(H,20,25)(H,21,24)(H,22,23)(H,26,27)/t11-,12-,13-/m0/s1 |
| SMILES | CC(C)C[C@H](NC(=O)[C@@H](N)CCCCN)C(=O)N[C@@H](CCC(=O)O)C(=O)O |
MNX internals
| InChI (mnx) | InChI=1/C17H32N4O6/c1-10(2)9-13(21-15(24)11(19)5-3-4-8-18)16(25)20-12(17(26)27)6-7-14(22)23/h10-13H,3-9,18-19H2,1-2H3,(H,20,25)(H,21,24)(H,22,23)(H,26,27)/t11-,12-,13-/m0/s1 |
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| SMILES (mnx) | [CH3:1][CH:10]([CH3:2])[CH2:9][C@@H:13]([C:16](=[N:20][C@@H:12]([CH2:6][CH2:7][C:14](=[O:22])[OH:23])[C:17](=[O:26])[OH:27])[OH:25])[N:21]=[C:15]([C@H:11]([CH2:5][CH2:3][CH2:4][CH2:8][NH2:18])[NH2:19])[OH:24] |
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