Glycoside
GD143400
Name:
8-{[3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl](hydroxy)methyl}-2-(3,4-dihydroxyphenyl)-5,7-dihydroxy-4H-chromen-4-oneFormula:
C21H20O11Smiles:
O=c1cc(-c2ccc(O)c(O)c2)oc2c(C(O)C3OC(CO)C(O)C3O)c(O)cc(O)c12Aglycone:
O=c1cc(-c2ccc(O)c(O)c2)oc2c(CO)c(O)cc(O)c12Sugarmoiety:
OCC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 11 | RingCount: | 4 |
| HBD: | 8 | FractionCSP3: | 0.29 |
| AlogP: | -0.2 | Num_rotatable_bonds: | 4 |
| MolWt: | 448.38 | Num_heavy_atoms: | 32 |
| TPSA: | 201.28 | NumAromaticRings: | 3 |
Unique Aglycone
AD57678
Formula: C16H12O7
Smiles:
O=c1cc(-c2ccc(O)c(O)c2)oc2c(CO)c(O)cc(O)c12| HBA: | 7 | RingCount: | 3 |
| HBD: | 5 | FractionCSP3: | 0.06 |
| AlogP: | 1.77 | Num_rotatable_bonds: | 2 |
| MolWt: | 316.26 | Num_heavy_atoms: | 23 |
| TPSA: | 131.36 | NumAromaticRings: | 3 |
