Glycoside

GD025307
Name:
NoneFormula:
C39H39O13NF2Smiles:
COC(=O)[C@@H]1O[C@H](Oc2ccc([C@@H]3[C@H](CC[C@H](OC(C)=O)c4ccc(F)cc4)C(=O)N3c3ccc(F)cc3)cc2)[C@H](OC(C)=O)[C@H](OC(C)=O)[C@H]1OC(C)=OAglycone:
CC(=O)OC(CCC1C(=O)N(c2ccc(F)cc2)C1c1ccc(O)cc1)c1ccc(F)cc1Sugarmoiety:
COC(=O)C1OC(O)C(OC(C)=O)C(OC(C)=O)C1OC(C)=OOther Identifiers
Properties
HBA: | 14 | RingCount: | 5 |
HBD: | 0 | FractionCSP3: | 0.38 |
AlogP: | 4.83 | Num_rotatable_bonds: | 13 |
MolWt: | 767.73 | Num_heavy_atoms: | 55 |
TPSA: | 170.27 | NumAromaticRings: | 3 |
Unique Aglycone
AD05059
Formula: C26H23O4NF2
Smiles:
CC(=O)OC(CCC1C(=O)N(c2ccc(F)cc2)C1c1ccc(O)cc1)c1ccc(F)cc1HBA: | 5 | RingCount: | 4 |
HBD: | 1 | FractionCSP3: | 0.23 |
AlogP: | 5.46 | Num_rotatable_bonds: | 7 |
MolWt: | 451.47 | Num_heavy_atoms: | 33 |
TPSA: | 66.84 | NumAromaticRings: | 3 |