Glycoside
GD156574
Name:
2-[(4,8-dihydroxynaphthalen-1-yl)oxy]-6-{[(3,4,5-trihydroxyoxan-2-yl)oxy]methyl}oxane-3,4,5-triolFormula:
C21H26O12Smiles:
Oc1ccc(OC2OC(COC3OCC(O)C(O)C3O)C(O)C(O)C2O)c2c(O)cccc12Aglycone:
Oc1ccc(O)c2c(O)cccc12Sugarmoiety:
OC1COC(OCC2OC(O)C(O)C(O)C2O)C(O)C1OOther Identifiers
Properties
| HBA: | 12 | RingCount: | 4 |
| HBD: | 8 | FractionCSP3: | 0.52 |
| AlogP: | -2.11 | Num_rotatable_bonds: | 5 |
| MolWt: | 470.43 | Num_heavy_atoms: | 33 |
| TPSA: | 198.76 | NumAromaticRings: | 2 |
Unique Aglycone
AD09199
Formula: C10H8O3
Smiles:
Oc1ccc(O)c2c(O)cccc12| HBA: | 3 | RingCount: | 2 |
| HBD: | 3 | FractionCSP3: | 0.0 |
| AlogP: | 1.96 | Num_rotatable_bonds: | 0 |
| MolWt: | 176.17 | Num_heavy_atoms: | 13 |
| TPSA: | 60.69 | NumAromaticRings: | 2 |
