Glycoside
GD138008
Name:
DemethylalangisideFormula:
C24H29O10NSmiles:
C=CC1C(OC2OC(CO)C(O)C(O)C2O)OC=C2C(=O)N3CCc4cc(O)c(O)cc4C3CC21Aglycone:
C=CC1C(O)OC=C2C(=O)N3CCc4cc(O)c(O)cc4C3CC21Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 11 | RingCount: | 5 |
| HBD: | 6 | FractionCSP3: | 0.54 |
| AlogP: | -0.6 | Num_rotatable_bonds: | 4 |
| MolWt: | 491.49 | Num_heavy_atoms: | 35 |
| TPSA: | 169.38 | NumAromaticRings: | 1 |
Unique Aglycone
AD17239
Formula: C18H19O5N
Smiles:
C=CC1C(O)OC=C2C(=O)N3CCc4cc(O)c(O)cc4C3CC21| HBA: | 6 | RingCount: | 4 |
| HBD: | 3 | FractionCSP3: | 0.39 |
| AlogP: | 1.58 | Num_rotatable_bonds: | 1 |
| MolWt: | 329.35 | Num_heavy_atoms: | 24 |
| TPSA: | 90.23 | NumAromaticRings: | 1 |
