Glycoside
GD144396
Name:
3-ethyl-5,7-dihydroxy-2-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}-3,4-dihydro-2H-1-benzopyran-4-oneFormula:
C17H22O10Smiles:
CCC1C(=O)c2c(O)cc(O)cc2OC1OC1OC(CO)C(O)C(O)C1OAglycone:
CCC1C(=O)c2c(O)cc(O)cc2OC1OSugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 10 | RingCount: | 3 |
| HBD: | 6 | FractionCSP3: | 0.59 |
| AlogP: | -1.16 | Num_rotatable_bonds: | 4 |
| MolWt: | 386.35 | Num_heavy_atoms: | 27 |
| TPSA: | 166.14 | NumAromaticRings: | 1 |
Unique Aglycone
AD58033
Formula: C11H12O5
Smiles:
CCC1C(=O)c2c(O)cc(O)cc2OC1O| HBA: | 5 | RingCount: | 2 |
| HBD: | 3 | FractionCSP3: | 0.36 |
| AlogP: | 1.02 | Num_rotatable_bonds: | 1 |
| MolWt: | 224.21 | Num_heavy_atoms: | 16 |
| TPSA: | 86.99 | NumAromaticRings: | 1 |
