Glycoside
GD151444
Name:
10-{[3,4-dihydroxy-6-(hydroxymethyl)-5-methoxyoxan-2-yl]oxy}-7,9-dimethoxy-3-methyl-1H,3H,4H-naphtho[2,3-c]pyran-4-yl acetateFormula:
C25H32O11Smiles:
COc1cc(OC)c2c(OC3OC(CO)C(OC)C(O)C3O)c3c(cc2c1)C(OC(C)=O)C(C)OC3Aglycone:
COc1cc(OC)c2c(O)c3c(cc2c1)C(OC(C)=O)C(C)OC3Sugarmoiety:
COC1C(CO)OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 11 | RingCount: | 4 |
| HBD: | 3 | FractionCSP3: | 0.56 |
| AlogP: | 1.21 | Num_rotatable_bonds: | 7 |
| MolWt: | 508.52 | Num_heavy_atoms: | 36 |
| TPSA: | 142.37 | NumAromaticRings: | 2 |
Unique Aglycone
AD60401
Formula: C18H20O6
Smiles:
COc1cc(OC)c2c(O)c3c(cc2c1)C(OC(C)=O)C(C)OC3| HBA: | 6 | RingCount: | 3 |
| HBD: | 1 | FractionCSP3: | 0.39 |
| AlogP: | 3.09 | Num_rotatable_bonds: | 3 |
| MolWt: | 332.35 | Num_heavy_atoms: | 24 |
| TPSA: | 74.22 | NumAromaticRings: | 2 |
