Glycoside
GD141809
Name:
2-[4,5-dihydroxy-6-(hydroxymethyl)-3-methoxyoxan-2-yl]-1,6,7-trihydroxy-3-methoxy-9H-xanthen-9-oneFormula:
C21H22O11Smiles:
COc1cc2oc3cc(O)c(O)cc3c(=O)c2c(O)c1C1OC(CO)C(O)C(O)C1OCAglycone:
COc1cc(O)c2c(=O)c3cc(O)c(O)cc3oc2c1Sugarmoiety:
COC1C(O)OC(CO)C(O)C1OOther Identifiers
Properties
| HBA: | 11 | RingCount: | 4 |
| HBD: | 6 | FractionCSP3: | 0.38 |
| AlogP: | 0.24 | Num_rotatable_bonds: | 4 |
| MolWt: | 450.4 | Num_heavy_atoms: | 32 |
| TPSA: | 179.28 | NumAromaticRings: | 3 |
Unique Aglycone
AD18306
Formula: C14H10O6
Smiles:
COc1cc(O)c2c(=O)c3cc(O)c(O)cc3oc2c1| HBA: | 6 | RingCount: | 3 |
| HBD: | 3 | FractionCSP3: | 0.07 |
| AlogP: | 2.07 | Num_rotatable_bonds: | 1 |
| MolWt: | 274.23 | Num_heavy_atoms: | 20 |
| TPSA: | 100.13 | NumAromaticRings: | 3 |
