Glycoside
GD028931
Name:
NoneFormula:
C31H35O8NF2SSmiles:
COC1OC(CS(=O)(=O)Oc2ccc([C@@H]3[C@H](CCCc4ccc(F)cc4)CN3c3ccc(F)cc3)cc2)C(O)C(O)C1OAglycone:
CS(=O)(=O)Oc1ccc(C2C(CCCc3ccc(F)cc3)CN2c2ccc(F)cc2)cc1Sugarmoiety:
COC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 9 | RingCount: | 5 |
| HBD: | 3 | FractionCSP3: | 0.42 |
| AlogP: | 3.33 | Num_rotatable_bonds: | 11 |
| MolWt: | 619.68 | Num_heavy_atoms: | 43 |
| TPSA: | 125.76 | NumAromaticRings: | 3 |
Unique Aglycone
AD18864
Formula: C25H25O3NF2S
Smiles:
CS(=O)(=O)Oc1ccc(C2C(CCCc3ccc(F)cc3)CN2c2ccc(F)cc2)cc1| HBA: | 4 | RingCount: | 4 |
| HBD: | 0 | FractionCSP3: | 0.28 |
| AlogP: | 5.5 | Num_rotatable_bonds: | 8 |
| MolWt: | 457.54 | Num_heavy_atoms: | 32 |
| TPSA: | 46.61 | NumAromaticRings: | 3 |
