Glycoside
...
GD001144

Name:
None

Formula:
C43H65O12N6F

Smiles:
CC[C@@H]1OC(=O)[C@@](C)(F)C(=O)[C@H](C)[C@H](O[C@@H]2O[C@H](CO)[C@H](O)[C@H](N(C)C)[C@H]2O)[C@@](C)(OC)C[C@H](C)C(=O)[C@H](C)[C@@H]2N(CCCCn3cc(-c4cccc(N)c4)nn3)C(=O)O[C@]12C

Aglycone:
CCC1OC(=O)C(C)(F)C(=O)C(C)C(O)C(C)(OC)CC(C)C(=O)C(C)C2N(CCCCn3cc(-c4cccc(N)c4)nn3)C(=O)OC12C

Sugarmoiety:
CN(C)C1C(O)C(O)OC(CO)C1O

Other Identifiers

Properties
HBA: 18 RingCount: 5
HBD: 5 FractionCSP3: 0.72
AlogP: 2.55 Num_rotatable_bonds: 12
MolWt: 877.02 Num_heavy_atoms: 62
TPSA: 238.33 NumAromaticRings: 2

Unique Aglycone
AD01194
Formula: C35H50O8N5F

Smiles:
CCC1OC(=O)C(C)(F)C(=O)C(C)C(O)C(C)(OC)CC(C)C(=O)C(C)C2N(CCCCn3cc(-c4cccc(N)c4)nn3)C(=O)OC12C
HBA: 13 RingCount: 4
HBD: 3 FractionCSP3: 0.66
AlogP: 4.15 Num_rotatable_bonds: 8
MolWt: 687.81 Num_heavy_atoms: 49
TPSA: 176.17 NumAromaticRings: 2

Sugarmoiety
SD00328

CN(C)C1C(O)C(O)OC(CO)C1O