Glycoside
GD132119
Name:
O-MethylisoalangisideFormula:
C26H33O10NSmiles:
C=CC1C(OC2OC(CO)C(O)C(O)C2O)OC=C2C(=O)N3CCc4cc(OC)c(OC)cc4C3CC21Aglycone:
C=CC1C(O)OC=C2C(=O)N3CCc4cc(OC)c(OC)cc4C3CC21Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 11 | RingCount: | 5 |
| HBD: | 4 | FractionCSP3: | 0.58 |
| AlogP: | 0.01 | Num_rotatable_bonds: | 6 |
| MolWt: | 519.55 | Num_heavy_atoms: | 37 |
| TPSA: | 147.38 | NumAromaticRings: | 1 |
Unique Aglycone
AD53489
Formula: C20H23O5N
Smiles:
C=CC1C(O)OC=C2C(=O)N3CCc4cc(OC)c(OC)cc4C3CC21| HBA: | 6 | RingCount: | 4 |
| HBD: | 1 | FractionCSP3: | 0.45 |
| AlogP: | 2.18 | Num_rotatable_bonds: | 3 |
| MolWt: | 357.41 | Num_heavy_atoms: | 26 |
| TPSA: | 68.23 | NumAromaticRings: | 1 |
