Glycoside
GD129149
Name:
7-hydroxy-6-(2-hydroxy-3-methyl-3-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}butyl)-2H-chromen-2-oneFormula:
C20H26O10Smiles:
CC(C)(OC1OC(CO)C(O)C(O)C1O)C(O)Cc1cc2ccc(=O)oc2cc1OAglycone:
CC(C)(O)C(O)Cc1cc2ccc(=O)oc2cc1OSugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 10 | RingCount: | 3 |
| HBD: | 6 | FractionCSP3: | 0.55 |
| AlogP: | -1.0 | Num_rotatable_bonds: | 6 |
| MolWt: | 426.42 | Num_heavy_atoms: | 30 |
| TPSA: | 170.05 | NumAromaticRings: | 2 |
Unique Aglycone
AD14616
Formula: C14H16O5
Smiles:
CC(C)(O)C(O)Cc1cc2ccc(=O)oc2cc1O| HBA: | 5 | RingCount: | 2 |
| HBD: | 3 | FractionCSP3: | 0.36 |
| AlogP: | 1.17 | Num_rotatable_bonds: | 3 |
| MolWt: | 264.28 | Num_heavy_atoms: | 19 |
| TPSA: | 90.9 | NumAromaticRings: | 2 |
