Glycoside
GD158361
Name:
methyl 1-hydroxy-4-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}naphthalene-2-carboxylateFormula:
C18H20O9Smiles:
COC(=O)c1cc(OC2OC(CO)C(O)C(O)C2O)c2ccccc2c1OAglycone:
COC(=O)c1cc(O)c2ccccc2c1OSugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 9 | RingCount: | 3 |
| HBD: | 5 | FractionCSP3: | 0.39 |
| AlogP: | -0.49 | Num_rotatable_bonds: | 4 |
| MolWt: | 380.35 | Num_heavy_atoms: | 27 |
| TPSA: | 145.91 | NumAromaticRings: | 2 |
Unique Aglycone
AD62518
Formula: C12H10O4
Smiles:
COC(=O)c1cc(O)c2ccccc2c1O| HBA: | 4 | RingCount: | 2 |
| HBD: | 2 | FractionCSP3: | 0.08 |
| AlogP: | 2.04 | Num_rotatable_bonds: | 1 |
| MolWt: | 218.21 | Num_heavy_atoms: | 16 |
| TPSA: | 66.76 | NumAromaticRings: | 2 |
