Glycoside
GD135470
Name:
Swertiajaposide AFormula:
C17H24O10Smiles:
C=CC1C2=C(C(=O)OCC2)C(OC)OC1OC1OC(CO)C(O)C(O)C1OAglycone:
C=CC1C2=C(C(=O)OCC2)C(OC)OC1OSugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 10 | RingCount: | 3 |
| HBD: | 4 | FractionCSP3: | 0.71 |
| AlogP: | -1.82 | Num_rotatable_bonds: | 5 |
| MolWt: | 388.37 | Num_heavy_atoms: | 27 |
| TPSA: | 144.14 | NumAromaticRings: | 0 |
Unique Aglycone
AD54775
Formula: C11H14O5
Smiles:
C=CC1C2=C(C(=O)OCC2)C(OC)OC1O| HBA: | 5 | RingCount: | 2 |
| HBD: | 1 | FractionCSP3: | 0.55 |
| AlogP: | 0.35 | Num_rotatable_bonds: | 2 |
| MolWt: | 226.23 | Num_heavy_atoms: | 16 |
| TPSA: | 64.99 | NumAromaticRings: | 0 |
