Glycoside
GD142800
Name:
2-{[4-hydroxy-2-(4-hydroxyphenyl)-5,7-dimethoxy-3,4-dihydro-2H-1-benzopyran-3-yl]oxy}-6-methyloxane-3,4,5-triolFormula:
C23H28O10Smiles:
COc1cc(OC)c2c(c1)OC(c1ccc(O)cc1)C(OC1OC(C)C(O)C(O)C1O)C2OAglycone:
COc1cc(OC)c2c(c1)OC(c1ccc(O)cc1)C(O)C2OSugarmoiety:
CC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 10 | RingCount: | 4 |
| HBD: | 5 | FractionCSP3: | 0.48 |
| AlogP: | 0.79 | Num_rotatable_bonds: | 5 |
| MolWt: | 464.47 | Num_heavy_atoms: | 33 |
| TPSA: | 147.3 | NumAromaticRings: | 2 |
Unique Aglycone
AD57461
Formula: C17H18O6
Smiles:
COc1cc(OC)c2c(c1)OC(c1ccc(O)cc1)C(O)C2O| HBA: | 6 | RingCount: | 3 |
| HBD: | 3 | FractionCSP3: | 0.29 |
| AlogP: | 1.94 | Num_rotatable_bonds: | 3 |
| MolWt: | 318.33 | Num_heavy_atoms: | 23 |
| TPSA: | 88.38 | NumAromaticRings: | 2 |
