Glycoside
GD152578
Name:
1-hydroxy-4-(3-hydroxypropyl)-2-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}-9,10-dihydroanthracene-9,10-dioneFormula:
C23H24O10Smiles:
O=C1c2ccccc2C(=O)c2c(O)c(OC3OC(CO)C(O)C(O)C3O)cc(CCCO)c21Aglycone:
O=C1c2ccccc2C(=O)c2c(O)c(O)cc(CCCO)c21Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 10 | RingCount: | 4 |
| HBD: | 6 | FractionCSP3: | 0.39 |
| AlogP: | -0.73 | Num_rotatable_bonds: | 6 |
| MolWt: | 460.44 | Num_heavy_atoms: | 33 |
| TPSA: | 173.98 | NumAromaticRings: | 2 |
Unique Aglycone
AD60741
Formula: C17H14O5
Smiles:
O=C1c2ccccc2C(=O)c2c(O)c(O)cc(CCCO)c21| HBA: | 5 | RingCount: | 3 |
| HBD: | 3 | FractionCSP3: | 0.18 |
| AlogP: | 1.8 | Num_rotatable_bonds: | 3 |
| MolWt: | 298.29 | Num_heavy_atoms: | 22 |
| TPSA: | 94.83 | NumAromaticRings: | 2 |
