Glycoside
GD139802
Name:
6-[4-(5,7-dihydroxy-4-oxo-3,4-dihydro-2H-1-benzopyran-2-yl)phenoxy]-2,3,4,5-tetrahydroxyhexanalFormula:
C21H22O10Smiles:
O=CC(O)C(O)C(O)C(O)COc1ccc(C2CC(=O)c3c(O)cc(O)cc3O2)cc1Aglycone:
O=C1CC(c2ccccc2)Oc2cc(O)cc(O)c21Sugarmoiety:
O=CC(O)C(O)C(O)C(O)COOOther Identifiers
Properties
| HBA: | 10 | RingCount: | 3 |
| HBD: | 6 | FractionCSP3: | 0.33 |
| AlogP: | -0.17 | Num_rotatable_bonds: | 8 |
| MolWt: | 434.4 | Num_heavy_atoms: | 31 |
| TPSA: | 173.98 | NumAromaticRings: | 2 |
Unique Aglycone
AD07333
Formula: C15H12O4
Smiles:
O=C1CC(c2ccccc2)Oc2cc(O)cc(O)c21| HBA: | 4 | RingCount: | 3 |
| HBD: | 2 | FractionCSP3: | 0.13 |
| AlogP: | 2.8 | Num_rotatable_bonds: | 1 |
| MolWt: | 256.26 | Num_heavy_atoms: | 19 |
| TPSA: | 66.76 | NumAromaticRings: | 2 |
