Glycoside
GD149947
Name:
1-hydroxy-7-methoxy-3-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]-9H-xanthen-9-oneFormula:
C20H20O9Smiles:
COc1ccc2oc3cc(C4OC(CO)C(O)C(O)C4O)cc(O)c3c(=O)c2c1Aglycone:
COc1ccc2oc3cccc(O)c3c(=O)c2c1Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 9 | RingCount: | 4 |
| HBD: | 5 | FractionCSP3: | 0.35 |
| AlogP: | 0.18 | Num_rotatable_bonds: | 3 |
| MolWt: | 404.37 | Num_heavy_atoms: | 29 |
| TPSA: | 149.82 | NumAromaticRings: | 3 |
Unique Aglycone
AD59930
Formula: C14H10O4
Smiles:
COc1ccc2oc3cccc(O)c3c(=O)c2c1| HBA: | 4 | RingCount: | 3 |
| HBD: | 1 | FractionCSP3: | 0.07 |
| AlogP: | 2.66 | Num_rotatable_bonds: | 1 |
| MolWt: | 242.23 | Num_heavy_atoms: | 18 |
| TPSA: | 59.67 | NumAromaticRings: | 3 |
