| Properties | Image |
| MNX_ID | MNXM1125225 |
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| reference | chebi:162636 |
| formula | C15H28N4O5S |
| global charge | 0 |
| mol weight | 376.479 |
| InChIKey | GJLXZITZLUUXMJ-NHCYSSNCSA-N |
| InChI | InChI=1S/C15H28N4O5S/c1-8(2)12(19-13(21)9(16)4-5-11(17)20)14(22)18-10(15(23)24)6-7-25-3/h8-10,12H,4-7,16H2,1-3H3,(H2,17,20)(H,18,22)(H,19,21)(H,23,24)/t9-,10-,12-/m0/s1 |
| SMILES | CSCC[C@H](NC(=O)[C@@H](NC(=O)[C@@H](N)CCC(N)=O)C(C)C)C(=O)O |
MNX internals
| InChI (mnx) | InChI=1/C15H28N4O5S/c1-8(2)12(19-13(21)9(16)4-5-11(17)20)14(22)18-10(15(23)24)6-7-25-3/h8-10,12H,4-7,16H2,1-3H3,(H2,17,20)(H,18,22)(H,19,21)(H,23,24)/t9-,10-,12-/m0/s1 |
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| SMILES (mnx) | [CH3:1][CH:8]([CH3:2])[C@@H:12]([C:14](=[N:18][C@@H:10]([CH2:6][CH2:7][S:25][CH3:3])[C:15](=[O:23])[OH:24])[OH:22])[N:19]=[C:13]([C@H:9]([CH2:4][CH2:5][C:11](=[NH:17])[OH:20])[NH2:16])[OH:21] |
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