| Properties | Image |
| MNX_ID | MNXM1121031 |
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| reference | chebi:158418 |
| formula | C11H21N3O4S |
| global charge | 0 |
| mol weight | 291.373 |
| InChIKey | OEQKGSPBDVKYOC-ZKWXMUAHSA-N |
| InChI | InChI=1S/C11H21N3O4S/c1-3-6(2)9(12)10(16)13-4-8(15)14-7(5-19)11(17)18/h6-7,9,19H,3-5,12H2,1-2H3,(H,13,16)(H,14,15)(H,17,18)/t6-,7-,9-/m0/s1 |
| SMILES | CC[C@H](C)[C@H](N)C(=O)NCC(=O)N[C@@H](CS)C(=O)O |
MNX internals
| InChI (mnx) | InChI=1/C11H21N3O4S/c1-3-6(2)9(12)10(16)13-4-8(15)14-7(5-19)11(17)18/h6-7,9,19H,3-5,12H2,1-2H3,(H,13,16)(H,14,15)(H,17,18)/t6-,7-,9-/m0/s1 |
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| SMILES (mnx) | [CH3:1][CH2:3][C@H:6]([CH3:2])[C@@H:9]([C:10](=[N:13][CH2:4][C:8](=[N:14][C@@H:7]([CH2:5][SH:19])[C:11](=[O:17])[OH:18])[OH:15])[OH:16])[NH2:12] |
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