Glycoside
GD114368
Name:
7-{[3,4,5-trihydroxy-4,6-bis(hydroxymethyl)oxan-2-yl]oxy}-2H-chromen-2-oneFormula:
C16H18O9Smiles:
O=c1ccc2ccc(OC3OC(CO)C(O)C(O)(CO)C3O)cc2o1Aglycone:
O=c1ccc2ccc(O)cc2o1Sugarmoiety:
OCC1OC(O)C(O)C(O)(CO)C1OOther Identifiers
Properties
| HBA: | 9 | RingCount: | 3 |
| HBD: | 5 | FractionCSP3: | 0.44 |
| AlogP: | -1.67 | Num_rotatable_bonds: | 4 |
| MolWt: | 354.31 | Num_heavy_atoms: | 25 |
| TPSA: | 149.82 | NumAromaticRings: | 2 |
Unique Aglycone
AD07479
Formula: C9H6O3
Smiles:
O=c1ccc2ccc(O)cc2o1| HBA: | 3 | RingCount: | 2 |
| HBD: | 1 | FractionCSP3: | 0.0 |
| AlogP: | 1.5 | Num_rotatable_bonds: | 0 |
| MolWt: | 162.14 | Num_heavy_atoms: | 12 |
| TPSA: | 50.44 | NumAromaticRings: | 2 |
