Glycoside
...
GD095436

Name:
None

Formula:
C19H28O8N6

Smiles:
CC(C)(C)OC(=O)NCCCc1cn([C@]2(CO)O[C@@H](n3ccc(=O)[nH]c3=O)[C@@H](O)[C@@H]2O)nn1

Aglycone:
CC(C)(C)OC(=O)NCCCC1=C[N]N=N1.O=c1cc[nH]c(=O)[nH]1

Sugarmoiety:
OCC1(O)OC(O)C(O)C1O

Other Identifiers

Properties
HBA: 14 RingCount: 3
HBD: 5 FractionCSP3: 0.63
AlogP: -1.82 Num_rotatable_bonds: 7
MolWt: 468.47 Num_heavy_atoms: 33
TPSA: 193.82 NumAromaticRings: 2

Unique Aglycone
AD00106
Formula: C4H4O2N2

Smiles:
O=c1cc[nH]c(=O)[nH]1
HBA: 4 RingCount: 1
HBD: 2 FractionCSP3: 0.0
AlogP: -0.94 Num_rotatable_bonds: 0
MolWt: 112.09 Num_heavy_atoms: 8
TPSA: 65.72 NumAromaticRings: 1
AD34166
Formula: C10H17O2N4

Smiles:
CC(C)(C)OC(=O)NCCCC1=C[N]N=N1
HBA: 6 RingCount: 1
HBD: 1 FractionCSP3: 0.7
AlogP: 2.12 Num_rotatable_bonds: 4
MolWt: 225.27 Num_heavy_atoms: 16
TPSA: 77.15 NumAromaticRings: 0

Sugarmoiety
SD01068

OCC1(O)OC(O)C(O)C1O