Glycoside
GD118110
Name:
(3,4,5,6-tetrahydroxyoxan-2-yl)methyl 3-phenylprop-2-enoateFormula:
C15H18O7Smiles:
O=C(C=Cc1ccccc1)OCC1OC(O)C(O)C(O)C1OAglycone:
COC(=O)C=Cc1ccccc1Sugarmoiety:
OC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 7 | RingCount: | 2 |
| HBD: | 4 | FractionCSP3: | 0.4 |
| AlogP: | -0.96 | Num_rotatable_bonds: | 4 |
| MolWt: | 310.3 | Num_heavy_atoms: | 22 |
| TPSA: | 116.45 | NumAromaticRings: | 1 |
Unique Aglycone
AD00648
Formula: C10H10O2
Smiles:
COC(=O)C=Cc1ccccc1| HBA: | 2 | RingCount: | 1 |
| HBD: | 0 | FractionCSP3: | 0.1 |
| AlogP: | 1.87 | Num_rotatable_bonds: | 2 |
| MolWt: | 162.19 | Num_heavy_atoms: | 12 |
| TPSA: | 26.3 | NumAromaticRings: | 1 |
