Glycoside
GD022102
Name:
NoneFormula:
C31H33O8NF2Smiles:
CO[C@@H]1O[C@H](COc2ccc([C@@H]3[C@H](CC[C@H](O)c4ccc(F)cc4)C(=O)N3c3ccc(F)cc3)cc2)[C@H](O)[C@H](O)[C@H]1OAglycone:
COc1ccc(C2C(CCC(O)c3ccc(F)cc3)C(=O)N2c2ccc(F)cc2)cc1Sugarmoiety:
COC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 9 | RingCount: | 5 |
| HBD: | 4 | FractionCSP3: | 0.39 |
| AlogP: | 3.02 | Num_rotatable_bonds: | 10 |
| MolWt: | 585.6 | Num_heavy_atoms: | 42 |
| TPSA: | 128.92 | NumAromaticRings: | 3 |
Unique Aglycone
AD06245
Formula: C25H23O3NF2
Smiles:
COc1ccc(C2C(CCC(O)c3ccc(F)cc3)C(=O)N2c2ccc(F)cc2)cc1| HBA: | 4 | RingCount: | 4 |
| HBD: | 1 | FractionCSP3: | 0.24 |
| AlogP: | 5.19 | Num_rotatable_bonds: | 7 |
| MolWt: | 423.46 | Num_heavy_atoms: | 31 |
| TPSA: | 49.77 | NumAromaticRings: | 3 |
