Glycoside
...
GD031623

Name:
None

Formula:
C32H27O9N4F

Smiles:
COc1c2occc2c(OC)c2c(=O)c(-c3cc(-c4ccc(F)cc4)c4c(N=C[C@H](O)[C@H](O)[C@H](O)CO)ncnc4n3)c(C)oc12

Aglycone:
C=Nc1ncnc2nc(-c3c(C)oc4c(OC)c5occc5c(OC)c4c3=O)cc(-c3ccc(F)cc3)c12

Sugarmoiety:
OCC(O)C(O)C(O)O

Other Identifiers

Properties
HBA: 13 RingCount: 6
HBD: 4 FractionCSP3: 0.22
AlogP: 3.45 Num_rotatable_bonds: 9
MolWt: 630.58 Num_heavy_atoms: 46
TPSA: 193.76 NumAromaticRings: 6

Unique Aglycone
AD20356
Formula: C28H19O5N4F

Smiles:
C=Nc1ncnc2nc(-c3c(C)oc4c(OC)c5occc5c(OC)c4c3=O)cc(-c3ccc(F)cc3)c12
HBA: 9 RingCount: 6
HBD: 0 FractionCSP3: 0.11
AlogP: 6.01 Num_rotatable_bonds: 5
MolWt: 510.48 Num_heavy_atoms: 38
TPSA: 112.84 NumAromaticRings: 6

Sugarmoiety
SD00255

OCC(O)C(O)C(O)O