| Properties | Image |
| MNX_ID | MNXM1123253 |
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| reference | chebi:160653 |
| formula | C13H24N4O5S2 |
| global charge | 0 |
| mol weight | 380.492 |
| InChIKey | RCMDUFDXDYTXOK-CIUDSAMLSA-N |
| InChI | InChI=1S/C13H24N4O5S2/c1-24-5-4-7(14)11(19)16-8(2-3-10(15)18)12(20)17-9(6-23)13(21)22/h7-9,23H,2-6,14H2,1H3,(H2,15,18)(H,16,19)(H,17,20)(H,21,22)/t7-,8-,9-/m0/s1 |
| SMILES | CSCC[C@H](N)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CS)C(=O)O |
MNX internals
| InChI (mnx) | InChI=1/C13H24N4O5S2/c1-24-5-4-7(14)11(19)16-8(2-3-10(15)18)12(20)17-9(6-23)13(21)22/h7-9,23H,2-6,14H2,1H3,(H2,15,18)(H,16,19)(H,17,20)(H,21,22)/t7-,8-,9-/m0/s1 |
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| SMILES (mnx) | [CH3:1][S:24][CH2:5][CH2:4][C@@H:7]([C:11](=[N:16][C@@H:8]([CH2:2][CH2:3][C:10](=[NH:15])[OH:18])[C:12](=[N:17][C@@H:9]([CH2:6][SH:23])[C:13](=[O:21])[OH:22])[OH:20])[OH:19])[NH2:14] |
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