DBC
Summary
| Name: | (4S,5S)-4,5-BIS(MERCAPTOMETHYL)-1,3-DIOXOLAN-2-OL |
| Formula: | C5 H10 O3 S2 |
| Formal charge: | 0 |
| Formula weight: | 182.261 Da |
| Component type: | NON-POLYMER |
Chemical Identifiers
| Program | Version | Name |
| ACDLabs | 10.04 | (4S,5S)-4,5-bis(sulfanylmethyl)-1,3-dioxolan-2-ol |
| OpenEye OEToolkits | 1.5.0 | (4S,5S)-4,5-bis(sulfanylmethyl)-1,3-dioxolan-2-ol |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 10.04 | SCC1OC(O)OC1CS |
| SMILES_CANONICAL | CACTVS | 3.341 | O[C@@H]1O[C@H](CS)[C@@H](CS)O1 |
| SMILES | CACTVS | 3.341 | O[CH]1O[CH](CS)[CH](CS)O1 |
| SMILES_CANONICAL | OpenEye OEToolkits | 1.5.0 | C([C@@H]1[C@H](OC(O1)O)CS)S |
| SMILES | OpenEye OEToolkits | 1.5.0 | C(C1C(OC(O1)O)CS)S |
| InChI | InChI | 1.03 | InChI=1S/C5H10O3S2/c6-5-7-3(1-9)4(2-10)8-5/h3-6,9-10H,1-2H2/t3-,4-/m1/s1 |
| InChIKey | InChI | 1.03 | URSOFHABYVLXDS-QWWZWVQMSA-N |
