| Properties | Image |
| MNX_ID | MNXM1122666 |
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| reference | chebi:160060 |
| formula | C14H24N4O5S |
| global charge | 0 |
| mol weight | 360.436 |
| InChIKey | UWFOMGUWGPRVBW-GUBZILKMSA-N |
| InChI | InChI=1S/C14H24N4O5S/c1-24-6-4-9(14(22)23)17-12(20)10-3-2-5-18(10)13(21)8(15)7-11(16)19/h8-10H,2-7,15H2,1H3,(H2,16,19)(H,17,20)(H,22,23)/t8-,9-,10-/m0/s1 |
| SMILES | CSCC[C@H](NC(=O)[C@@H]1CCCN1C(=O)[C@@H](N)CC(N)=O)C(=O)O |
MNX internals
| InChI (mnx) | InChI=1/C14H24N4O5S/c1-24-6-4-9(14(22)23)17-12(20)10-3-2-5-18(10)13(21)8(15)7-11(16)19/h8-10H,2-7,15H2,1H3,(H2,16,19)(H,17,20)(H,22,23)/t8-,9-,10-/m0/s1 |
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| SMILES (mnx) | [CH3:1][S:24][CH2:6][CH2:4][C@@H:9]([C:14](=[O:22])[OH:23])[N:17]=[C:12]([C@@H:10]1[CH2:3][CH2:2][CH2:5][N:18]1[C:13]([C@H:8]([CH2:7][C:11](=[NH:16])[OH:19])[NH2:15])=[O:21])[OH:20] |
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