Glycoside
GD135417
Name:
(3,4,5,6-tetrahydroxyoxan-2-yl)methyl 3-(4-methoxyphenyl)prop-2-enoateFormula:
C16H20O8Smiles:
COc1ccc(C=CC(=O)OCC2OC(O)C(O)C(O)C2O)cc1Aglycone:
COC(=O)C=Cc1ccc(OC)cc1Sugarmoiety:
OC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 8 | RingCount: | 2 |
| HBD: | 4 | FractionCSP3: | 0.44 |
| AlogP: | -0.95 | Num_rotatable_bonds: | 5 |
| MolWt: | 340.33 | Num_heavy_atoms: | 24 |
| TPSA: | 125.68 | NumAromaticRings: | 1 |
Unique Aglycone
AD11989
Formula: C11H12O3
Smiles:
COC(=O)C=Cc1ccc(OC)cc1| HBA: | 3 | RingCount: | 1 |
| HBD: | 0 | FractionCSP3: | 0.18 |
| AlogP: | 1.88 | Num_rotatable_bonds: | 3 |
| MolWt: | 192.21 | Num_heavy_atoms: | 14 |
| TPSA: | 35.53 | NumAromaticRings: | 1 |
