Glycoside
GD116180
Name:
5-hydroxy-2-(4-hydroxyphenyl)-7-methoxy-4-oxo-3-[(3,4,5-trihydroxy-6-methyloxan-2-yl)oxy]-4H-chromen-8-yl acetateFormula:
C24H24O12Smiles:
COc1cc(O)c2c(=O)c(OC3OC(C)C(O)C(O)C3O)c(-c3ccc(O)cc3)oc2c1OC(C)=OAglycone:
COc1cc(O)c2c(=O)c(O)c(-c3ccc(O)cc3)oc2c1OC(C)=OSugarmoiety:
CC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 12 | RingCount: | 4 |
| HBD: | 5 | FractionCSP3: | 0.33 |
| AlogP: | 1.01 | Num_rotatable_bonds: | 5 |
| MolWt: | 504.44 | Num_heavy_atoms: | 36 |
| TPSA: | 185.35 | NumAromaticRings: | 3 |
Unique Aglycone
AD46092
Formula: C18H14O8
Smiles:
COc1cc(O)c2c(=O)c(O)c(-c3ccc(O)cc3)oc2c1OC(C)=O| HBA: | 8 | RingCount: | 3 |
| HBD: | 3 | FractionCSP3: | 0.11 |
| AlogP: | 2.51 | Num_rotatable_bonds: | 3 |
| MolWt: | 358.3 | Num_heavy_atoms: | 26 |
| TPSA: | 126.43 | NumAromaticRings: | 3 |
