Glycoside
GD022307
Name:
NAFENOPIN GLUCURONIDEFormula:
C25H30O8Smiles:
CC(C)(Oc1ccc(C2CCCc3ccccc32)cc1)C(=O)O[C@@H]1O[C@H](O)[C@H](O)[C@H](O)[C@H]1OAglycone:
CC(C)(Oc1ccc(C2CCCc3ccccc32)cc1)C(=O)OSugarmoiety:
OC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 8 | RingCount: | 4 |
| HBD: | 4 | FractionCSP3: | 0.48 |
| AlogP: | 1.61 | Num_rotatable_bonds: | 5 |
| MolWt: | 458.51 | Num_heavy_atoms: | 33 |
| TPSA: | 125.68 | NumAromaticRings: | 2 |
Unique Aglycone
AD15142
Formula: C20H22O3
Smiles:
CC(C)(Oc1ccc(C2CCCc3ccccc32)cc1)C(=O)O| HBA: | 3 | RingCount: | 3 |
| HBD: | 1 | FractionCSP3: | 0.35 |
| AlogP: | 4.4 | Num_rotatable_bonds: | 4 |
| MolWt: | 310.39 | Num_heavy_atoms: | 23 |
| TPSA: | 46.53 | NumAromaticRings: | 2 |
