Glycoside
GD149074
Name:
[3,4,5-trihydroxy-6-(4-hydroxy-3-methylidenebutoxy)oxan-2-yl]methyl 3-phenylprop-2-enoateFormula:
C20H26O8Smiles:
C=C(CO)CCOC1OC(COC(=O)C=Cc2ccccc2)C(O)C(O)C1OAglycone:
C=C(CO)CCO.COC(=O)C=Cc1ccccc1Sugarmoiety:
OC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 8 | RingCount: | 2 |
| HBD: | 4 | FractionCSP3: | 0.45 |
| AlogP: | 0.01 | Num_rotatable_bonds: | 9 |
| MolWt: | 394.42 | Num_heavy_atoms: | 28 |
| TPSA: | 125.68 | 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 |
AD59615
Formula: C5H10O2
Smiles:
C=C(CO)CCO| HBA: | 2 | RingCount: | 0 |
| HBD: | 2 | FractionCSP3: | 0.6 |
| AlogP: | -0.08 | Num_rotatable_bonds: | 3 |
| MolWt: | 102.13 | Num_heavy_atoms: | 7 |
| TPSA: | 40.46 | NumAromaticRings: | 0 |
