Glycoside
GD154034
Name:
1,6-dihydroxy-2-(hydroxymethyl)-5-[(3,4,5-trihydroxy-6-{[(3,4,5-trihydroxyoxan-2-yl)oxy]methyl}oxan-2-yl)oxy]-9,10-dihydroanthracene-9,10-dioneFormula:
C26H28O15Smiles:
O=C1c2ccc(O)c(OC3OC(COC4OCC(O)C(O)C4O)C(O)C(O)C3O)c2C(=O)c2ccc(CO)c(O)c21Aglycone:
O=C1c2ccc(CO)c(O)c2C(=O)c2ccc(O)c(O)c21Sugarmoiety:
OC1COC(OCC2OC(O)C(O)C(O)C2O)C(O)C1OOther Identifiers
Properties
| HBA: | 15 | RingCount: | 5 |
| HBD: | 9 | FractionCSP3: | 0.46 |
| AlogP: | -2.99 | Num_rotatable_bonds: | 6 |
| MolWt: | 580.5 | Num_heavy_atoms: | 41 |
| TPSA: | 253.13 | NumAromaticRings: | 2 |
Unique Aglycone
AD61218
Formula: C15H10O6
Smiles:
O=C1c2ccc(CO)c(O)c2C(=O)c2ccc(O)c(O)c21| HBA: | 6 | RingCount: | 3 |
| HBD: | 4 | FractionCSP3: | 0.07 |
| AlogP: | 1.07 | Num_rotatable_bonds: | 1 |
| MolWt: | 286.24 | Num_heavy_atoms: | 21 |
| TPSA: | 115.06 | NumAromaticRings: | 2 |
