Glycoside
GD014773
Name:
Codeine GlucuronideFormula:
C24H29O9NSmiles:
COc1ccc2c3c1O[C@@H]1[C@H](O[C@@H]4O[C@H](C(=O)O)[C@H](O)[C@H](O)[C@H]4O)C=C[C@@H]4[C@H](C2)N(C)CC[C@@]341Aglycone:
COc1ccc2c3c1OC1C(O)C=CC4C(C2)N(C)CCC341Sugarmoiety:
O=C(O)C1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 10 | RingCount: | 6 |
| HBD: | 4 | FractionCSP3: | 0.62 |
| AlogP: | -0.58 | Num_rotatable_bonds: | 4 |
| MolWt: | 475.49 | Num_heavy_atoms: | 34 |
| TPSA: | 138.15 | NumAromaticRings: | 1 |
Unique Aglycone
AD10823
Formula: C18H21O3N
Smiles:
COc1ccc2c3c1OC1C(O)C=CC4C(C2)N(C)CCC341| HBA: | 4 | RingCount: | 5 |
| HBD: | 1 | FractionCSP3: | 0.56 |
| AlogP: | 1.5 | Num_rotatable_bonds: | 1 |
| MolWt: | 299.37 | Num_heavy_atoms: | 22 |
| TPSA: | 41.93 | NumAromaticRings: | 1 |
