Glycoside
...
GD098003

Name:
None

Formula:
C20H23O9N5

Smiles:
CC(=O)OC[C@H]1O[C@@H](n2cc(-c3cnc(N)nc3C)c(=O)[nH]c2=O)[C@H](OC(C)=O)[C@@H]1OC(C)=O

Aglycone:
COC(C)=O.Cc1nc(N)ncc1-c1c[nH]c(=O)[nH]c1=O

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

Other Identifiers

Properties
HBA: 14 RingCount: 3
HBD: 3 FractionCSP3: 0.45
AlogP: -0.79 Num_rotatable_bonds: 6
MolWt: 477.43 Num_heavy_atoms: 34
TPSA: 194.79 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
AD41696
Formula: C9H9O2N5

Smiles:
Cc1nc(N)ncc1-c1c[nH]c(=O)[nH]c1=O
HBA: 7 RingCount: 2
HBD: 4 FractionCSP3: 0.11
AlogP: -0.59 Num_rotatable_bonds: 1
MolWt: 219.2 Num_heavy_atoms: 16
TPSA: 117.52 NumAromaticRings: 2

Sugarmoiety
SD00105

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