Glycoside
GD143362
Name:
3-({10-hydroxy-9-methoxy-3-methyl-1H,3H,4H-naphtho[2,3-c]pyran-7-yl}oxy)-6-(hydroxymethyl)-5-methoxyoxane-2,4-diolFormula:
C22H28O9Smiles:
COc1cc(OC2C(O)OC(CO)C(OC)C2O)cc2cc3c(c(O)c12)COC(C)C3Aglycone:
COc1cc(O)cc2cc3c(c(O)c12)COC(C)C3Sugarmoiety:
COC1C(CO)OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 9 | RingCount: | 4 |
| HBD: | 4 | FractionCSP3: | 0.55 |
| AlogP: | 0.85 | Num_rotatable_bonds: | 5 |
| MolWt: | 436.46 | Num_heavy_atoms: | 31 |
| TPSA: | 127.07 | NumAromaticRings: | 2 |
Unique Aglycone
AD57667
Formula: C15H16O4
Smiles:
COc1cc(O)cc2cc3c(c(O)c12)COC(C)C3| HBA: | 4 | RingCount: | 3 |
| HBD: | 2 | FractionCSP3: | 0.33 |
| AlogP: | 2.72 | Num_rotatable_bonds: | 1 |
| MolWt: | 260.29 | Num_heavy_atoms: | 19 |
| TPSA: | 58.92 | NumAromaticRings: | 2 |
