Glycoside
...
GD037573

Name:
None

Formula:
C34H42O9N7FS2

Smiles:
C[C@@H]1O[C@H](CNS(=O)(=O)c2ccc(CCn3cc(CCN4CCN(c5cc6c(cc5F)c(=O)c(C(=O)O)cn6C5CC5)CC4)nn3)s2)[C@H](O)[C@H](O)[C@H]1O

Aglycone:
CNS(=O)(=O)c1ccc(CCn2cc(CCN3CCN(c4cc5c(cc4F)c(=O)c(C(=O)O)cn5C4CC4)CC3)nn2)s1

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

Other Identifiers

Properties
HBA: 16 RingCount: 7
HBD: 5 FractionCSP3: 0.53
AlogP: 0.58 Num_rotatable_bonds: 13
MolWt: 775.88 Num_heavy_atoms: 53
TPSA: 212.58 NumAromaticRings: 4

Unique Aglycone
AD23652
Formula: C28H32O5N7FS2

Smiles:
CNS(=O)(=O)c1ccc(CCn2cc(CCN3CCN(c4cc5c(cc4F)c(=O)c(C(=O)O)cn5C4CC4)CC3)nn2)s1
HBA: 12 RingCount: 6
HBD: 2 FractionCSP3: 0.43
AlogP: 2.34 Num_rotatable_bonds: 11
MolWt: 629.74 Num_heavy_atoms: 43
TPSA: 142.66 NumAromaticRings: 4

Sugarmoiety
SD00076

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