Glycoside
GD146113
Name:
1,3,5-trihydroxy-2,7-dimethyl-8-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}-9,10-dihydroanthracene-9,10-dioneFormula:
C22H22O11Smiles:
Cc1cc(O)c2c(c1OC1OC(CO)C(O)C(O)C1O)C(=O)c1c(cc(O)c(C)c1O)C2=OAglycone:
Cc1cc(O)c2c(c1O)C(=O)c1c(cc(O)c(C)c1O)C2=OSugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 11 | RingCount: | 4 |
| HBD: | 7 | FractionCSP3: | 0.36 |
| AlogP: | -0.63 | Num_rotatable_bonds: | 3 |
| MolWt: | 462.41 | Num_heavy_atoms: | 33 |
| TPSA: | 194.21 | NumAromaticRings: | 2 |
Unique Aglycone
AD58611
Formula: C16H12O6
Smiles:
Cc1cc(O)c2c(c1O)C(=O)c1c(cc(O)c(C)c1O)C2=O| HBA: | 6 | RingCount: | 3 |
| HBD: | 4 | FractionCSP3: | 0.12 |
| AlogP: | 1.9 | Num_rotatable_bonds: | 0 |
| MolWt: | 300.27 | Num_heavy_atoms: | 22 |
| TPSA: | 115.06 | NumAromaticRings: | 2 |
