89Y
Summary
| Name: | (3R,4R)-3,4-dihydroxy-4-(hydroxymethyl)oxolan-2-one |
| Formula: | C5 H8 O5 |
| Formal charge: | 0 |
| Formula weight: | 148.114 Da |
| Component type: | D-saccharide |
Chemical Identifiers
| Program | Version | Name |
| ACDLabs | 12.01 | (3R,4R)-3,4-dihydroxy-4-(hydroxymethyl)oxolan-2-one |
| OpenEye OEToolkits | 2.0.6 | (3~{R},4~{R})-4-(hydroxymethyl)-3,4-bis(oxidanyl)oxolan-2-one |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 12.01 | OC1C(=O)OCC1(O)CO |
| InChI | InChI | 1.03 | InChI=1S/C5H8O5/c6-1-5(9)2-10-4(8)3(5)7/h3,6-7,9H,1-2H2/t3-,5+/m0/s1 |
| InChIKey | InChI | 1.03 | MTSAHRPUAGVYCZ-WVZVXSGGSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | OC[C@@]1(O)COC(=O)[C@@H]1O |
| SMILES | CACTVS | 3.385 | OC[C]1(O)COC(=O)[CH]1O |
| SMILES_CANONICAL | OpenEye OEToolkits | 2.0.6 | C1[C@@]([C@H](C(=O)O1)O)(CO)O |
| SMILES | OpenEye OEToolkits | 2.0.6 | C1C(C(C(=O)O1)O)(CO)O |
