Glycoside

GD037435
Name:
NoneFormula:
C30H35O13NF2Smiles:
COc1cc([C@@H]2c3cc4c(cc3[C@H](NCC(F)(F)[C@]3(O)O[C@H](CO)[C@H](O)[C@H](O)[C@H]3O)[C@@H]3COC(=O)[C@@H]23)OCO4)cc(OC)c1OCAglycone:
COc1cc(C2c3cc4c(cc3C(NCC(F)F)C3COC(=O)C23)OCO4)cc(OC)c1OCSugarmoiety:
OCC1OC(O)(O)C(O)C(O)C1OOther Identifiers
Properties
HBA: | 14 | RingCount: | 6 |
HBD: | 6 | FractionCSP3: | 0.57 |
AlogP: | -0.2 | Num_rotatable_bonds: | 9 |
MolWt: | 655.6 | Num_heavy_atoms: | 46 |
TPSA: | 194.86 | NumAromaticRings: | 2 |
Unique Aglycone
AD23585
Formula: C24H25O7NF2
Smiles:
COc1cc(C2c3cc4c(cc3C(NCC(F)F)C3COC(=O)C23)OCO4)cc(OC)c1OCHBA: | 8 | RingCount: | 5 |
HBD: | 1 | FractionCSP3: | 0.46 |
AlogP: | 3.27 | Num_rotatable_bonds: | 7 |
MolWt: | 477.46 | Num_heavy_atoms: | 34 |
TPSA: | 84.48 | NumAromaticRings: | 2 |