Glycoside
GD117924
Name:
5-hydroxy-3-(4-hydroxyphenyl)-6-methoxy-7-[(3,4,5-trihydroxy-6-methyloxan-2-yl)oxy]-4H-chromen-4-oneFormula:
C22H22O10Smiles:
COc1c(OC2OC(C)C(O)C(O)C2O)cc2occ(-c3ccc(O)cc3)c(=O)c2c1OAglycone:
COc1c(O)cc2occ(-c3ccc(O)cc3)c(=O)c2c1OSugarmoiety:
CC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 10 | RingCount: | 4 |
| HBD: | 5 | FractionCSP3: | 0.32 |
| AlogP: | 1.09 | Num_rotatable_bonds: | 4 |
| MolWt: | 446.41 | Num_heavy_atoms: | 32 |
| TPSA: | 159.05 | NumAromaticRings: | 3 |
Unique Aglycone
AD14621
Formula: C16H12O6
Smiles:
COc1c(O)cc2occ(-c3ccc(O)cc3)c(=O)c2c1O| HBA: | 6 | RingCount: | 3 |
| HBD: | 3 | FractionCSP3: | 0.06 |
| AlogP: | 2.59 | Num_rotatable_bonds: | 2 |
| MolWt: | 300.27 | Num_heavy_atoms: | 22 |
| TPSA: | 100.13 | NumAromaticRings: | 3 |
