Glycoside
GD149052
Name:
2-hydroxy-3-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}propyl 3-[4-(acetyloxy)-3-hydroxyphenyl]prop-2-enoateFormula:
C20H26O12Smiles:
CC(=O)Oc1ccc(C=CC(=O)OCC(O)COC2OC(CO)C(O)C(O)C2O)cc1OAglycone:
CC(=O)Oc1ccc(C=CC(=O)OCC(O)CO)cc1OSugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 12 | RingCount: | 2 |
| HBD: | 6 | FractionCSP3: | 0.5 |
| AlogP: | -1.95 | Num_rotatable_bonds: | 9 |
| MolWt: | 458.42 | Num_heavy_atoms: | 32 |
| TPSA: | 192.44 | NumAromaticRings: | 1 |
Unique Aglycone
AD59608
Formula: C14H16O7
Smiles:
CC(=O)Oc1ccc(C=CC(=O)OCC(O)CO)cc1O| HBA: | 7 | RingCount: | 1 |
| HBD: | 3 | FractionCSP3: | 0.29 |
| AlogP: | 0.23 | Num_rotatable_bonds: | 6 |
| MolWt: | 296.27 | Num_heavy_atoms: | 21 |
| TPSA: | 113.29 | NumAromaticRings: | 1 |
