3S6
Summary
| Name: | prop-2-en-1-yl beta-D-galactofuranoside |
| Synonyms: | prop-2-en-1-yl beta-D-galactoside prop-2-en-1-yl D-galactoside; prop-2-en-1-yl galactoside |
| Formula: | C9 H16 O6 |
| Formal charge: | 0 |
| Formula weight: | 220.22 Da |
| Component type: | D-saccharide |
Chemical Identifiers
| Program | Version | Name |
| ACDLabs | 12.01 | prop-2-en-1-yl beta-D-galactofuranoside |
| OpenEye OEToolkits | 1.9.2 | (2S,3R,4R,5R)-2-[(1R)-1,2-bis(oxidanyl)ethyl]-5-prop-2-enoxy-oxolane-3,4-diol |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 12.01 | O(C/C=C)C1OC(C(O)C1O)C(O)CO |
| InChI | InChI | 1.03 | InChI=1S/C9H16O6/c1-2-3-14-9-7(13)6(12)8(15-9)5(11)4-10/h2,5-13H,1,3-4H2/t5-,6-,7-,8+,9-/m1/s1 |
| InChIKey | InChI | 1.03 | ZOIPKVBHIUBYNB-GOFVFXDOSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | OC[C@@H](O)[C@@H]1O[C@@H](OCC=C)[C@H](O)[C@H]1O |
| SMILES | CACTVS | 3.385 | OC[CH](O)[CH]1O[CH](OCC=C)[CH](O)[CH]1O |
| SMILES_CANONICAL | OpenEye OEToolkits | 1.9.2 | C=CCO[C@H]1[C@@H]([C@H]([C@@H](O1)[C@@H](CO)O)O)O |
| SMILES | OpenEye OEToolkits | 1.9.2 | C=CCOC1C(C(C(O1)C(CO)O)O)O |
