Glycoside
...
GD024067

Name:
None

Formula:
C46H52O10N10

Smiles:
O=C(Nc1cc(OCCN2CCCC2)c2ccccc2n1)c1cc(OCc2cn([C@@H]3O[C@H](CO)[C@H](O)[C@H](O)[C@H]3O)nn2)cc(C(=O)Nc2cc(OCCN3CCCC3)c3ccccc3n2)n1

Aglycone:
O=C(Nc1cc(OCCN2CCCC2)c2ccccc2n1)c1cc(OCC2=C[N]N=N2)cc(C(=O)Nc2cc(OCCN3CCCC3)c3ccccc3n2)n1

Sugarmoiety:
OCC1OC(O)C(O)C(O)C1O

Other Identifiers

Properties
HBA: 20 RingCount: 9
HBD: 6 FractionCSP3: 0.41
AlogP: 2.77 Num_rotatable_bonds: 17
MolWt: 904.98 Num_heavy_atoms: 66
TPSA: 251.9 NumAromaticRings: 6

Unique Aglycone
AD16110
Formula: C40H41O5N10

Smiles:
O=C(Nc1cc(OCCN2CCCC2)c2ccccc2n1)c1cc(OCC2=C[N]N=N2)cc(C(=O)Nc2cc(OCCN3CCCC3)c3ccccc3n2)n1
HBA: 15 RingCount: 8
HBD: 2 FractionCSP3: 0.33
AlogP: 5.84 Num_rotatable_bonds: 15
MolWt: 741.83 Num_heavy_atoms: 55
TPSA: 169.86 NumAromaticRings: 5

Sugarmoiety
SD00003

OCC1OC(O)C(O)C(O)C1O