| Properties | Image |
| MNX_ID | MNXM1126422 |
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| reference | chebi:163836 |
| formula | C11H22N4O4S |
| global charge | 0 |
| mol weight | 306.388 |
| InChIKey | VLIJYPMATZSOLL-YUMQZZPRSA-N |
| InChI | InChI=1S/C11H22N4O4S/c12-4-2-1-3-7(14-9(16)5-13)10(17)15-8(6-20)11(18)19/h7-8,20H,1-6,12-13H2,(H,14,16)(H,15,17)(H,18,19)/t7-,8-/m0/s1 |
| SMILES | NCCCC[C@H](NC(=O)CN)C(=O)N[C@@H](CS)C(=O)O |
MNX internals
| InChI (mnx) | InChI=1/C11H22N4O4S/c12-4-2-1-3-7(14-9(16)5-13)10(17)15-8(6-20)11(18)19/h7-8,20H,1-6,12-13H2,(H,14,16)(H,15,17)(H,18,19)/t7-,8-/m0/s1 |
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| SMILES (mnx) | [CH2:1]([CH2:2][CH2:4][NH2:12])[CH2:3][C@@H:7]([C:10](=[N:15][C@@H:8]([CH2:6][SH:20])[C:11](=[O:18])[OH:19])[OH:17])[N:14]=[C:9]([CH2:5][NH2:13])[OH:16] |
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