Glycoside
GD119556
Name:
2,3,5-trihydroxy-6-methyloxan-4-yl 3-(4-methoxyphenyl)prop-2-enoateFormula:
C16H20O7Smiles:
COc1ccc(C=CC(=O)OC2C(O)C(C)OC(O)C2O)cc1Aglycone:
COc1ccc(C=CC(=O)O)cc1Sugarmoiety:
CC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 7 | RingCount: | 2 |
| HBD: | 3 | FractionCSP3: | 0.44 |
| AlogP: | 0.08 | Num_rotatable_bonds: | 4 |
| MolWt: | 324.33 | Num_heavy_atoms: | 23 |
| TPSA: | 105.45 | NumAromaticRings: | 1 |
Unique Aglycone
AD02513
Formula: C10H10O3
Smiles:
COc1ccc(C=CC(=O)O)cc1| HBA: | 3 | RingCount: | 1 |
| HBD: | 1 | FractionCSP3: | 0.1 |
| AlogP: | 1.79 | Num_rotatable_bonds: | 3 |
| MolWt: | 178.19 | Num_heavy_atoms: | 13 |
| TPSA: | 46.53 | NumAromaticRings: | 1 |
