| Properties | Image |
| MNX_ID | MNXM1123879 |
 |
| reference | chebi:161281 |
| formula | C14H26N4O5S |
| global charge | 0 |
| mol weight | 362.452 |
| InChIKey | YZKOXEJTLWZOQL-GUBZILKMSA-N |
| InChI | InChI=1S/C14H26N4O5S/c1-7(2)5-10(14(22)23)18-13(21)9(3-4-11(16)19)17-12(20)8(15)6-24/h7-10,24H,3-6,15H2,1-2H3,(H2,16,19)(H,17,20)(H,18,21)(H,22,23)/t8-,9-,10-/m0/s1 |
| SMILES | CC(C)C[C@H](NC(=O)[C@H](CCC(N)=O)NC(=O)[C@@H](N)CS)C(=O)O |
MNX internals
| InChI (mnx) | InChI=1/C14H26N4O5S/c1-7(2)5-10(14(22)23)18-13(21)9(3-4-11(16)19)17-12(20)8(15)6-24/h7-10,24H,3-6,15H2,1-2H3,(H2,16,19)(H,17,20)(H,18,21)(H,22,23)/t8-,9-,10-/m0/s1 |
 |
| SMILES (mnx) | [CH3:1][CH:7]([CH3:2])[CH2:5][C@@H:10]([C:14](=[O:22])[OH:23])[N:18]=[C:13]([C@H:9]([CH2:3][CH2:4][C:11](=[NH:16])[OH:19])[N:17]=[C:12]([C@H:8]([CH2:6][SH:24])[NH2:15])[OH:20])[OH:21] |
|