Glycoside
GD104542
Name:
Testosterone GlucuronideFormula:
C25H36O8Smiles:
C[C@]12CCC(=O)C=C1CC[C@@H]1[C@@H]2CC[C@@]2(C)[C@@H](O[C@H]3O[C@H](C(=O)O)[C@H](O)[C@@H](O)[C@@H]3O)CC[C@H]12Aglycone:
CC12CCC(=O)C=C1CCC1C2CCC2(C)C(O)CCC12Sugarmoiety:
O=C(O)C1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 8 | RingCount: | 5 |
| HBD: | 4 | FractionCSP3: | 0.84 |
| AlogP: | 1.8 | Num_rotatable_bonds: | 3 |
| MolWt: | 464.56 | Num_heavy_atoms: | 33 |
| TPSA: | 133.52 | NumAromaticRings: | 0 |
Unique Aglycone
AD17322
Formula: C19H28O2
Smiles:
CC12CCC(=O)C=C1CCC1C2CCC2(C)C(O)CCC12| HBA: | 2 | RingCount: | 4 |
| HBD: | 1 | FractionCSP3: | 0.84 |
| AlogP: | 3.88 | Num_rotatable_bonds: | 0 |
| MolWt: | 288.43 | Num_heavy_atoms: | 21 |
| TPSA: | 37.3 | NumAromaticRings: | 0 |
