TVG
Summary
Name: | propyl beta-D-galactofuranoside |
Formula: | C9 H18 O6 |
Formal charge: | 0 |
Formula weight: | 222.236 Da |
Component type: | D-saccharide |
Chemical Identifiers
Program | Version | Name |
ACDLabs | 12.01 | propyl beta-D-galactofuranoside |
OpenEye OEToolkits | 2.0.7 | (2~{S},3~{R},4~{R},5~{R})-2-[(1~{R})-1,2-bis(oxidanyl)ethyl]-5-propoxy-oxolane-3,4-diol |
Chemical Descriptors
Type | Program | Version | Descriptor |
SMILES | ACDLabs | 12.01 | OC1C(OC(C1O)OCCC)C(CO)O |
InChI | InChI | 1.03 | InChI=1S/C9H18O6/c1-2-3-14-9-7(13)6(12)8(15-9)5(11)4-10/h5-13H,2-4H2,1H3/t5-,6-,7-,8+,9-/m1/s1 |
InChIKey | InChI | 1.03 | HCLWENMJMONBDC-GOFVFXDOSA-N |
SMILES_CANONICAL | CACTVS | 3.385 | CCCO[C@@H]1O[C@@H]([C@H](O)CO)[C@H](O)[C@H]1O |
SMILES | CACTVS | 3.385 | CCCO[CH]1O[CH]([CH](O)CO)[CH](O)[CH]1O |
SMILES_CANONICAL | OpenEye OEToolkits | 2.0.7 | CCCO[C@H]1[C@@H]([C@H]([C@@H](O1)[C@@H](CO)O)O)O |
SMILES | OpenEye OEToolkits | 2.0.7 | CCCOC1C(C(C(O1)C(CO)O)O)O |