Glycoside
GD151235
Name:
1-hydroxy-7-(hydroxymethyl)-2,5-dimethoxy-4-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}-9,10-dihydroanthracene-9,10-dioneFormula:
C23H24O12Smiles:
COc1cc(OC2OC(CO)C(O)C(O)C2O)c2c(c1O)C(=O)c1cc(CO)cc(OC)c1C2=OAglycone:
COc1cc(O)c2c(c1O)C(=O)c1cc(CO)cc(OC)c1C2=OSugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 12 | RingCount: | 4 |
| HBD: | 6 | FractionCSP3: | 0.39 |
| AlogP: | -1.14 | Num_rotatable_bonds: | 6 |
| MolWt: | 492.43 | Num_heavy_atoms: | 35 |
| TPSA: | 192.44 | NumAromaticRings: | 2 |
Unique Aglycone
AD47723
Formula: C17H14O7
Smiles:
COc1cc(O)c2c(c1O)C(=O)c1cc(CO)cc(OC)c1C2=O| HBA: | 7 | RingCount: | 3 |
| HBD: | 3 | FractionCSP3: | 0.18 |
| AlogP: | 1.38 | Num_rotatable_bonds: | 3 |
| MolWt: | 330.29 | Num_heavy_atoms: | 24 |
| TPSA: | 113.29 | NumAromaticRings: | 2 |
