Glycoside
...
GD035343

Name:
None

Formula:
C35H50O11N3F

Smiles:
C[C@@H]1O[C@H](O[C@@H]2C[C@H](O)[C@]3(CO)[C@H]4[C@H](CC[C@@]3(O)C2)[C@]2(O)CC[C@@H](C(O)c3cn(Cc5ccc(F)cc5)nn3)[C@@]2(C)C[C@H]4O)[C@H](O)[C@H](O)[C@H]1O

Aglycone:
CC12CC(O)C3C(CCC4(O)CC(O)CC(O)C34CO)C1(O)CCC2C(O)c1cn(Cc2ccc(F)cc2)nn1

Sugarmoiety:
CC1OC(O)C(O)C(O)C1O

Other Identifiers

Properties
HBA: 14 RingCount: 7
HBD: 9 FractionCSP3: 0.77
AlogP: -0.49 Num_rotatable_bonds: 7
MolWt: 707.79 Num_heavy_atoms: 50
TPSA: 231.24 NumAromaticRings: 2

Unique Aglycone
AD22373
Formula: C29H40O7N3F

Smiles:
CC12CC(O)C3C(CCC4(O)CC(O)CC(O)C34CO)C1(O)CCC2C(O)c1cn(Cc2ccc(F)cc2)nn1
HBA: 10 RingCount: 6
HBD: 7 FractionCSP3: 0.72
AlogP: 0.66 Num_rotatable_bonds: 5
MolWt: 561.65 Num_heavy_atoms: 40
TPSA: 172.32 NumAromaticRings: 2

Sugarmoiety
SD00076

CC1OC(O)C(O)C(O)C1O