Glycoside
GD141024
Name:
5-hydroxy-7-methoxy-2-{4-[(3,4,5-trihydroxy-6-methyloxan-2-yl)oxy]phenyl}-3,4-dihydro-2H-1-benzopyran-4-oneFormula:
C22H24O9Smiles:
COc1cc(O)c2c(c1)OC(c1ccc(OC3OC(C)C(O)C(O)C3O)cc1)CC2=OAglycone:
COc1cc(O)c2c(c1)OC(c1ccc(O)cc1)CC2=OSugarmoiety:
CC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 9 | RingCount: | 4 |
| HBD: | 4 | FractionCSP3: | 0.41 |
| AlogP: | 1.31 | Num_rotatable_bonds: | 4 |
| MolWt: | 432.43 | Num_heavy_atoms: | 31 |
| TPSA: | 134.91 | NumAromaticRings: | 2 |
Unique Aglycone
AD14944
Formula: C16H14O5
Smiles:
COc1cc(O)c2c(c1)OC(c1ccc(O)cc1)CC2=O| HBA: | 5 | RingCount: | 3 |
| HBD: | 2 | FractionCSP3: | 0.19 |
| AlogP: | 2.81 | Num_rotatable_bonds: | 2 |
| MolWt: | 286.28 | Num_heavy_atoms: | 21 |
| TPSA: | 75.99 | NumAromaticRings: | 2 |
