Glycoside
GD136775
Name:
2-[3-(4-hydroxy-2,6-dimethoxybenzoyl)phenoxy]-6-(hydroxymethyl)oxane-3,4,5-triolFormula:
C21H24O10Smiles:
COc1cc(O)cc(OC)c1C(=O)c1cccc(OC2OC(CO)C(O)C(O)C2O)c1Aglycone:
COc1cc(O)cc(OC)c1C(=O)c1cccc(O)c1Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 10 | RingCount: | 3 |
| HBD: | 5 | FractionCSP3: | 0.38 |
| AlogP: | -0.18 | Num_rotatable_bonds: | 7 |
| MolWt: | 436.41 | Num_heavy_atoms: | 31 |
| TPSA: | 155.14 | NumAromaticRings: | 2 |
Unique Aglycone
AD55285
Formula: C15H14O5
Smiles:
COc1cc(O)cc(OC)c1C(=O)c1cccc(O)c1| HBA: | 5 | RingCount: | 2 |
| HBD: | 2 | FractionCSP3: | 0.13 |
| AlogP: | 2.35 | Num_rotatable_bonds: | 4 |
| MolWt: | 274.27 | Num_heavy_atoms: | 20 |
| TPSA: | 75.99 | NumAromaticRings: | 2 |
