| PDB CCD ID: | MSN |
| Number of entries in BioLiP: | 2 |
| Chemical formula: | C6 H13 N O3 S |
| InChI: | InChI=1S/C6H13NO3S/c1-11-6-2(7)3(8)4(9)5(6)10/h2-6,8-10H,7H2,1H3/t2-,3+,4+,5+,6+/m0/s1 |
| InChIKey: | BLOFGONIVNXZME-YDMGZANHSA-N |
| SMILES: | | Software | SMILES |
|---|
| OpenEye OEToolkits 1.5.0 | CS[C@@H]1[C@H]([C@H]([C@H]([C@H]1O)O)O)N | | CACTVS 3.341 | CS[CH]1[CH](N)[CH](O)[CH](O)[CH]1O | | OpenEye OEToolkits 1.5.0 | CSC1C(C(C(C1O)O)O)N | | ACDLabs 10.04 | OC1C(O)C(N)C(SC)C1O | | CACTVS 3.341 | CS[C@@H]1[C@@H](N)[C@@H](O)[C@@H](O)[C@H]1O |
|
| Name: | (1R,2R,3R,4S,5R)-4-AMINO-5-(METHYLTHIO)CYCLOPENTANE-1,2,3-TRIOL |
| ChEMBL: | CHEMBL9623 |
| ZINC: | ZINC000006019793 |
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