Glycoside
GD153078
Name:
6-hydroxy-4,5-dimethyl-3-methylidene-8-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}-3,4-dihydro-1H-2-benzopyran-1-oneFormula:
C18H22O9Smiles:
C=C1OC(=O)c2c(OC3OC(CO)C(O)C(O)C3O)cc(O)c(C)c2C1CAglycone:
C=C1OC(=O)c2c(O)cc(O)c(C)c2C1CSugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 9 | RingCount: | 3 |
| HBD: | 5 | FractionCSP3: | 0.5 |
| AlogP: | -0.33 | Num_rotatable_bonds: | 3 |
| MolWt: | 382.37 | Num_heavy_atoms: | 27 |
| TPSA: | 145.91 | NumAromaticRings: | 1 |
Unique Aglycone
AD60909
Formula: C12H12O4
Smiles:
C=C1OC(=O)c2c(O)cc(O)c(C)c2C1C| HBA: | 4 | RingCount: | 2 |
| HBD: | 2 | FractionCSP3: | 0.25 |
| AlogP: | 2.19 | Num_rotatable_bonds: | 0 |
| MolWt: | 220.22 | Num_heavy_atoms: | 16 |
| TPSA: | 66.76 | NumAromaticRings: | 1 |
