Glycoside
GD130809
Name:
1,3,6,7-tetrahydroxy-2-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]-9,9a-dihydro-4aH-xanthen-9-oneFormula:
C19H20O11Smiles:
O=C1c2cc(O)c(O)cc2OC2C=C(O)C(C3OC(CO)C(O)C(O)C3O)=C(O)C12Aglycone:
O=C1c2cc(O)c(O)cc2OC2C=C(O)C=C(O)C12Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 11 | RingCount: | 4 |
| HBD: | 8 | FractionCSP3: | 0.42 |
| AlogP: | -1.23 | Num_rotatable_bonds: | 2 |
| MolWt: | 424.36 | Num_heavy_atoms: | 30 |
| TPSA: | 197.37 | NumAromaticRings: | 1 |
Unique Aglycone
AD46284
Formula: C13H10O6
Smiles:
O=C1c2cc(O)c(O)cc2OC2C=C(O)C=C(O)C12| HBA: | 6 | RingCount: | 3 |
| HBD: | 4 | FractionCSP3: | 0.15 |
| AlogP: | 1.56 | Num_rotatable_bonds: | 0 |
| MolWt: | 262.22 | Num_heavy_atoms: | 19 |
| TPSA: | 107.22 | NumAromaticRings: | 1 |
