| Properties | Image |
| MNX_ID | MNXM1128238 |
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| reference | chebi:166279 |
| formula | C14H28N4O4S |
| global charge | 0 |
| mol weight | 348.469 |
| InChIKey | SJLVYVZBFDTRCG-DCAQKATOSA-N |
| InChI | InChI=1S/C14H28N4O4S/c1-8(2)11(16)13(20)17-9(5-3-4-6-15)12(19)18-10(7-23)14(21)22/h8-11,23H,3-7,15-16H2,1-2H3,(H,17,20)(H,18,19)(H,21,22)/t9-,10-,11-/m0/s1 |
| SMILES | CC(C)[C@H](N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CS)C(=O)O |
MNX internals
| InChI (mnx) | InChI=1/C14H28N4O4S/c1-8(2)11(16)13(20)17-9(5-3-4-6-15)12(19)18-10(7-23)14(21)22/h8-11,23H,3-7,15-16H2,1-2H3,(H,17,20)(H,18,19)(H,21,22)/t9-,10-,11-/m0/s1 |
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| SMILES (mnx) | [CH3:1][CH:8]([CH3:2])[C@@H:11]([C:13](=[N:17][C@@H:9]([CH2:5][CH2:3][CH2:4][CH2:6][NH2:15])[C:12](=[N:18][C@@H:10]([CH2:7][SH:23])[C:14](=[O:21])[OH:22])[OH:19])[OH:20])[NH2:16] |
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