Glycoside
GD148078
Name:
(octahydro-1H-quinolizin-1-yl)methyl 3-(3-methoxy-4-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}phenyl)prop-2-enoateFormula:
C26H37O9NSmiles:
COc1cc(C=CC(=O)OCC2CCCN3CCCCC23)ccc1OC1OC(CO)C(O)C(O)C1OAglycone:
COc1cc(C=CC(=O)OCC2CCCN3CCCCC23)ccc1OSugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 10 | RingCount: | 4 |
| HBD: | 4 | FractionCSP3: | 0.65 |
| AlogP: | 0.69 | Num_rotatable_bonds: | 8 |
| MolWt: | 507.58 | Num_heavy_atoms: | 36 |
| TPSA: | 138.15 | NumAromaticRings: | 1 |
Unique Aglycone
AD57529
Formula: C20H27O4N
Smiles:
COc1cc(C=CC(=O)OCC2CCCN3CCCCC23)ccc1O| HBA: | 5 | RingCount: | 3 |
| HBD: | 1 | FractionCSP3: | 0.55 |
| AlogP: | 3.22 | Num_rotatable_bonds: | 5 |
| MolWt: | 345.44 | Num_heavy_atoms: | 25 |
| TPSA: | 59.0 | NumAromaticRings: | 1 |
