| Properties | Image |
|---|
| MNX_ID | MNXM744782 |
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| reference | biggM:lyscyshis |
| formula | C15H27N6O4S |
| global charge | 1 |
| mol weight | 387.486 |
| InChIKey | QQYRCUXKLDGCQN-UTUOFQBUSA-O |
| InChI | InChI=1S/C15H26N6O4S/c16-4-2-1-3-10(17)13(22)21-12(7-26)14(23)20-11(15(24)25)5-9-6-18-8-19-9/h6,8,10-12,26H,1-5,7,16-17H2,(H,18,19)(H,20,23)(H,21,22)(H,24,25)/p+1/t10-,11-,12+/m1/s1 |
| SMILES | N[C@H](CCCC[NH3+])C(=O)N[C@@H](CS)C(=O)N[C@H](CC1=CNC=N1)C(=O)O |
MNX internals
| InChI (mnx) | InChI=1/C15H26N6O4S/c16-4-2-1-3-10(17)13(22)21-12(7-26)14(23)20-11(15(24)25)5-9-6-18-8-19-9/h6,8,10-12,26H,1-5,7,16-17H2,(H,18,19)(H,20,23)(H,21,22)(H,24,25)/t10-,11-,12+/m1/s1 |
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| SMILES (mnx) | [CH2:1]([CH2:2][CH2:4][NH2:16])[CH2:3][C@H:10]([C:13](=[N:21][C@@H:12]([CH2:7][SH:26])[C:14](=[N:20][C@H:11]([CH2:5][C:9]1=[CH:6][N:18]=[CH:8][NH:19]1)[C:15](=[O:24])[OH:25])[OH:23])[OH:22])[NH2:17] |
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