| Properties | Image |
| MNX_ID | MNXM1126413 |
 |
| reference | chebi:163827 |
| formula | C15H28N4O6 |
| global charge | 0 |
| mol weight | 360.411 |
| InChIKey | RKDFEMGVMMYYNG-WDCWCFNPSA-N |
| InChI | InChI=1S/C15H28N4O6/c1-7(2)6-10(15(24)25)19-13(22)9(4-5-11(16)21)18-14(23)12(17)8(3)20/h7-10,12,20H,4-6,17H2,1-3H3,(H2,16,21)(H,18,23)(H,19,22)(H,24,25)/t8-,9+,10+,12+/m1/s1 |
| SMILES | CC(C)C[C@H](NC(=O)[C@H](CCC(N)=O)NC(=O)[C@@H](N)[C@@H](C)O)C(=O)O |
MNX internals
| InChI (mnx) | InChI=1/C15H28N4O6/c1-7(2)6-10(15(24)25)19-13(22)9(4-5-11(16)21)18-14(23)12(17)8(3)20/h7-10,12,20H,4-6,17H2,1-3H3,(H2,16,21)(H,18,23)(H,19,22)(H,24,25)/t8-,9+,10+,12+/m1/s1 |
 |
| SMILES (mnx) | [CH3:1][CH:7]([CH3:2])[CH2:6][C@@H:10]([C:15](=[O:24])[OH:25])[N:19]=[C:13]([C@H:9]([CH2:4][CH2:5][C:11](=[NH:16])[OH:21])[N:18]=[C:14]([C@H:12]([C@@H:8]([CH3:3])[OH:20])[NH2:17])[OH:23])[OH:22] |
|