Glycoside
...
GD005801

Name:
None

Formula:
C51H83O13N8F

Smiles:
COc1c(N2C[C@@H]3CCCN(CCCCCCCCCCCCO[C@H]4[C@H](O[C@@H]5O[C@H](CN)[C@H](O)C[C@H]5N)[C@@H](N)C[C@@H](N)[C@H]4O[C@@H]4O[C@H](CO)[C@H](O)[C@H](N)[C@H]4O)[C@H]3C2)c(F)cc2c(=O)c(C(=O)O)cn(C3CC3)c12

Aglycone:
COc1c(N2CC3CCCN(CCCCCCCCCCCCOC4C(O)C(N)CC(N)C4OC4OC(CN)C(O)CC4N)C3C2)c(F)cc2c(=O)c(C(=O)O)cn(C3CC3)c12

Sugarmoiety:
NC1C(O)C(O)OC(CO)C1O

Other Identifiers

Properties
HBA: 21 RingCount: 8
HBD: 15 FractionCSP3: 0.8
AlogP: 0.73 Num_rotatable_bonds: 24
MolWt: 1035.27 Num_heavy_atoms: 73
TPSA: 332.18 NumAromaticRings: 2

Unique Aglycone
AD04874
Formula: C45H72O9N7F

Smiles:
COc1c(N2CC3CCCN(CCCCCCCCCCCCOC4C(O)C(N)CC(N)C4OC4OC(CN)C(O)CC4N)C3C2)c(F)cc2c(=O)c(C(=O)O)cn(C3CC3)c12
HBA: 16 RingCount: 7
HBD: 11 FractionCSP3: 0.78
AlogP: 2.94 Num_rotatable_bonds: 21
MolWt: 874.11 Num_heavy_atoms: 62
TPSA: 247.24 NumAromaticRings: 2

Sugarmoiety
SD00372

NC1C(O)C(O)OC(CO)C1O