Glycoside
...
GD019936

Name:
None

Formula:
C20H25O9N5

Smiles:
CCOC(=O)Cc1nc2c(N)ncnc2n1C1OC(COC(C)=O)C(OC(C)=O)C1OC(C)=O

Aglycone:
CCOC(=O)CC1=Nc2c(N)ncnc2[N]1.COC(C)=O

Sugarmoiety:
CC(=O)OC1C(O)OC(O)C1OC(C)=O

Other Identifiers

Properties
HBA: 14 RingCount: 3
HBD: 2 FractionCSP3: 0.55
AlogP: -0.16 Num_rotatable_bonds: 8
MolWt: 479.45 Num_heavy_atoms: 34
TPSA: 184.05 NumAromaticRings: 2

Unique Aglycone
AD00017
Formula: C3H6O2

Smiles:
COC(C)=O
HBA: 2 RingCount: 0
HBD: 0 FractionCSP3: 0.67
AlogP: 0.18 Num_rotatable_bonds: 0
MolWt: 74.08 Num_heavy_atoms: 5
TPSA: 26.3 NumAromaticRings: 0
AD13839
Formula: C9H10O2N5

Smiles:
CCOC(=O)CC1=Nc2c(N)ncnc2[N]1
HBA: 7 RingCount: 2
HBD: 2 FractionCSP3: 0.33
AlogP: 0.29 Num_rotatable_bonds: 3
MolWt: 220.21 Num_heavy_atoms: 16
TPSA: 104.56 NumAromaticRings: 1

Sugarmoiety
SD00105

CC(=O)OC1C(O)OC(O)C1OC(C)=O