Glycoside
GD118704
Name:
7-hydroxy-5-methoxy-4-{3-methyl-4-[(3,4,5-trihydroxyoxan-2-yl)oxy]but-2-en-1-yl}-1,3-dihydro-2-benzofuran-1-oneFormula:
C19H24O9Smiles:
COc1cc(O)c2c(c1CC=C(C)COC1OCC(O)C(O)C1O)COC2=OAglycone:
COc1cc(O)c2c(c1CC=C(C)CO)COC2=OSugarmoiety:
OC1COC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 9 | RingCount: | 3 |
| HBD: | 4 | FractionCSP3: | 0.53 |
| AlogP: | 0.02 | Num_rotatable_bonds: | 6 |
| MolWt: | 396.39 | Num_heavy_atoms: | 28 |
| TPSA: | 134.91 | NumAromaticRings: | 1 |
Unique Aglycone
AD47486
Formula: C14H16O5
Smiles:
COc1cc(O)c2c(c1CC=C(C)CO)COC2=O| HBA: | 5 | RingCount: | 2 |
| HBD: | 2 | FractionCSP3: | 0.36 |
| AlogP: | 1.55 | Num_rotatable_bonds: | 4 |
| MolWt: | 264.28 | Num_heavy_atoms: | 19 |
| TPSA: | 75.99 | NumAromaticRings: | 1 |
