B27
Summary
| Name: | (2R,3S) 3-amino-4-mercapto-2-butanol |
| Synonyms: | (2R,3S)-3-amino-4-sulfanylbutan-2-ol |
| Formula: | C4 H11 N O S |
| Formal charge: | 0 |
| Formula weight: | 121.201 Da |
| Component type: | L-PEPTIDE COOH CARBOXY TERMINUS |
Chemical Identifiers
| Program | Version | Name |
| ACDLabs | 10.04 | (2R,3S)-3-amino-4-sulfanylbutan-2-ol |
| OpenEye OEToolkits | 1.5.0 | (2R,3S)-3-amino-4-sulfanyl-butan-2-ol |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 10.04 | OC(C)C(N)CS |
| SMILES_CANONICAL | CACTVS | 3.341 | C[C@@H](O)[C@H](N)CS |
| SMILES | CACTVS | 3.341 | C[CH](O)[CH](N)CS |
| SMILES_CANONICAL | OpenEye OEToolkits | 1.5.0 | C[C@H]([C@@H](CS)N)O |
| SMILES | OpenEye OEToolkits | 1.5.0 | CC(C(CS)N)O |
| InChI | InChI | 1.03 | InChI=1S/C4H11NOS/c1-3(6)4(5)2-7/h3-4,6-7H,2,5H2,1H3/t3-,4-/m1/s1 |
| InChIKey | InChI | 1.03 | LXDJRZZMWYIUAR-QWWZWVQMSA-N |
