Glycoside
...
GD110584

Name:
None

Formula:
C25H35O9N5

Smiles:
CCCCCCCCC(=O)Nc1nc2c(ncn2[C@@H]2O[C@@H](COC(C)=O)[C@@H](OC(C)=O)[C@@H]2OC(C)=O)c(=O)[nH]1

Aglycone:
CCCCCCCCC(=O)Nc1nc2c(c(=O)[nH]1)N=C[N]2.COC(C)=O

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

Other Identifiers

Properties
HBA: 14 RingCount: 3
HBD: 2 FractionCSP3: 0.64
AlogP: 2.13 Num_rotatable_bonds: 13
MolWt: 549.58 Num_heavy_atoms: 39
TPSA: 180.8 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
AD44655
Formula: C14H20O2N5

Smiles:
CCCCCCCCC(=O)Nc1nc2c(c(=O)[nH]1)N=C[N]2
HBA: 7 RingCount: 2
HBD: 2 FractionCSP3: 0.57
AlogP: 2.37 Num_rotatable_bonds: 8
MolWt: 290.35 Num_heavy_atoms: 21
TPSA: 101.31 NumAromaticRings: 1

Sugarmoiety
SD00105

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