Glycoside
GD143629
Name:
Beta-Anhydroepidigitoxigenin-3Beta-O-GlucopyranosideFormula:
C29H42O8Smiles:
CC12CCC3C(CCC4CC(OC5OC(CO)C(O)C(O)C5O)CCC43C)C1=CCC2C1=CC(=O)OC1Aglycone:
CC12CCC3C(CCC4CC(O)CCC43C)C1=CCC2C1=CC(=O)OC1Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 8 | RingCount: | 6 |
| HBD: | 4 | FractionCSP3: | 0.83 |
| AlogP: | 2.23 | Num_rotatable_bonds: | 4 |
| MolWt: | 518.65 | Num_heavy_atoms: | 37 |
| TPSA: | 125.68 | NumAromaticRings: | 0 |
Unique Aglycone
AD57757
Formula: C23H32O3
Smiles:
CC12CCC3C(CCC4CC(O)CCC43C)C1=CCC2C1=CC(=O)OC1| HBA: | 3 | RingCount: | 5 |
| HBD: | 1 | FractionCSP3: | 0.78 |
| AlogP: | 4.41 | Num_rotatable_bonds: | 1 |
| MolWt: | 356.51 | Num_heavy_atoms: | 26 |
| TPSA: | 46.53 | NumAromaticRings: | 0 |
