Glycoside
GD154291
Name:
2,6-dihydroxy-3-[(2-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}phenyl)methyl]benzoic acidFormula:
C20H22O10Smiles:
O=C(O)c1c(O)ccc(Cc2ccccc2OC2OC(CO)C(O)C(O)C2O)c1OAglycone:
O=C(O)c1c(O)ccc(Cc2ccccc2O)c1OSugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 10 | RingCount: | 3 |
| HBD: | 7 | FractionCSP3: | 0.35 |
| AlogP: | -0.43 | Num_rotatable_bonds: | 6 |
| MolWt: | 422.39 | Num_heavy_atoms: | 30 |
| TPSA: | 177.14 | NumAromaticRings: | 2 |
Unique Aglycone
AD61301
Formula: C14H12O5
Smiles:
O=C(O)c1c(O)ccc(Cc2ccccc2O)c1O| HBA: | 5 | RingCount: | 2 |
| HBD: | 4 | FractionCSP3: | 0.07 |
| AlogP: | 2.09 | Num_rotatable_bonds: | 3 |
| MolWt: | 260.24 | Num_heavy_atoms: | 19 |
| TPSA: | 97.99 | NumAromaticRings: | 2 |
