Glycoside
GD135273
Name:
6-{[6-(3,4-dimethoxyphenyl)-9-hydroxy-8-oxo-2H,8H-[1,3]dioxolo[4,5-g]chromen-7-yl]oxy}-3,4,5-trihydroxyoxane-2-carboxylic acidFormula:
C24H22O14Smiles:
COc1ccc(-c2oc3cc4c(c(O)c3c(=O)c2OC2OC(C(=O)O)C(O)C(O)C2O)OCO4)cc1OCAglycone:
COc1ccc(-c2oc3cc4c(c(O)c3c(=O)c2O)OCO4)cc1OCSugarmoiety:
O=C(O)C1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 14 | RingCount: | 5 |
| HBD: | 5 | FractionCSP3: | 0.33 |
| AlogP: | 0.18 | Num_rotatable_bonds: | 6 |
| MolWt: | 534.43 | Num_heavy_atoms: | 38 |
| TPSA: | 203.81 | NumAromaticRings: | 3 |
Unique Aglycone
AD54700
Formula: C18H14O8
Smiles:
COc1ccc(-c2oc3cc4c(c(O)c3c(=O)c2O)OCO4)cc1OC| HBA: | 8 | RingCount: | 4 |
| HBD: | 2 | FractionCSP3: | 0.17 |
| AlogP: | 2.62 | Num_rotatable_bonds: | 3 |
| MolWt: | 358.3 | Num_heavy_atoms: | 26 |
| TPSA: | 107.59 | NumAromaticRings: | 3 |
