| Properties | Image |
| MNX_ID | MNXM1121657 |
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| reference | chebi:159046 |
| formula | C15H30N6O4S |
| global charge | 0 |
| mol weight | 390.51 |
| InChIKey | HCIUUZGFTDTEGM-NAKRPEOUSA-N |
| InChI | InChI=1S/C15H30N6O4S/c1-3-8(2)11(13(23)20-10(7-26)14(24)25)21-12(22)9(16)5-4-6-19-15(17)18/h8-11,26H,3-7,16H2,1-2H3,(H,20,23)(H,21,22)(H,24,25)(H4,17,18,19)/t8-,9-,10-,11-/m0/s1 |
| SMILES | CC[C@H](C)[C@H](NC(=O)[C@@H](N)CCCN=C(N)N)C(=O)N[C@@H](CS)C(=O)O |
MNX internals
| InChI (mnx) | InChI=1/C15H30N6O4S/c1-3-8(2)11(13(23)20-10(7-26)14(24)25)21-12(22)9(16)5-4-6-19-15(17)18/h8-11,26H,3-7,16H2,1-2H3,(H,20,23)(H,21,22)(H,24,25)(H4,17,18,19)/t8-,9-,10-,11-/m0/s1 |
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| SMILES (mnx) | [CH3:1][CH2:3][C@H:8]([CH3:2])[C@@H:11]([C:13](=[N:20][C@@H:10]([CH2:7][SH:26])[C:14](=[O:24])[OH:25])[OH:23])[N:21]=[C:12]([C@H:9]([CH2:5][CH2:4][CH2:6][NH:19][C:15](=[NH:17])[NH2:18])[NH2:16])[OH:22] |
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