| Properties | Image |
| MNX_ID | MNXM1123120 |
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| reference | chebi:160520 |
| formula | C15H30N6O5S |
| global charge | 0 |
| mol weight | 406.509 |
| InChIKey | NKDSBBBPGIVWEI-RCWTZXSCSA-N |
| InChI | InChI=1S/C15H30N6O5S/c1-8(22)11(14(25)26)21-13(24)10(4-3-6-19-15(17)18)20-12(23)9(16)5-7-27-2/h8-11,22H,3-7,16H2,1-2H3,(H,20,23)(H,21,24)(H,25,26)(H4,17,18,19)/t8-,9+,10+,11+/m1/s1 |
| SMILES | CSCC[C@H](N)C(=O)N[C@@H](CCCN=C(N)N)C(=O)N[C@H](C(=O)O)[C@@H](C)O |
MNX internals
| InChI (mnx) | InChI=1/C15H30N6O5S/c1-8(22)11(14(25)26)21-13(24)10(4-3-6-19-15(17)18)20-12(23)9(16)5-7-27-2/h8-11,22H,3-7,16H2,1-2H3,(H,20,23)(H,21,24)(H,25,26)(H4,17,18,19)/t8-,9+,10+,11+/m1/s1 |
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| SMILES (mnx) | [CH3:1][C@H:8]([C@@H:11]([C:14](=[O:25])[OH:26])[N:21]=[C:13]([C@H:10]([CH2:4][CH2:3][CH2:6][NH:19][C:15](=[NH:17])[NH2:18])[N:20]=[C:12]([C@H:9]([CH2:5][CH2:7][S:27][CH3:2])[NH2:16])[OH:23])[OH:24])[OH:22] |
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