Glycoside
...
GD013626

Name:
None

Formula:
C51H63O6N5

Smiles:
NCCCCCCO[C@H]1[C@H](O[C@@H]2O[C@H](CN)[C@H](OCc3ccc4ccccc4c3)[C@H](OCc3ccc4ccccc4c3)[C@H]2N)[C@@H](N)C[C@@H](N)[C@H]1OCc1ccc2ccccc2c1

Aglycone:
NCCCCCCOC1C(O)C(N)CC(N)C1OCc1ccc2ccccc2c1.OCc1ccc2ccccc2c1.OCc1ccc2ccccc2c1

Sugarmoiety:
NCC1OC(O)C(N)C(O)C1O

Other Identifiers

Properties
HBA: 11 RingCount: 8
HBD: 10 FractionCSP3: 0.41
AlogP: 6.56 Num_rotatable_bonds: 19
MolWt: 842.09 Num_heavy_atoms: 62
TPSA: 185.48 NumAromaticRings: 6

Unique Aglycone
AD01045
Formula: C11H10O

Smiles:
OCc1ccc2ccccc2c1
HBA: 1 RingCount: 2
HBD: 1 FractionCSP3: 0.09
AlogP: 2.33 Num_rotatable_bonds: 1
MolWt: 158.2 Num_heavy_atoms: 12
TPSA: 20.23 NumAromaticRings: 2
AD10133
Formula: C23H35O3N3

Smiles:
NCCCCCCOC1C(O)C(N)CC(N)C1OCc1ccc2ccccc2c1
HBA: 6 RingCount: 3
HBD: 7 FractionCSP3: 0.57
AlogP: 2.05 Num_rotatable_bonds: 10
MolWt: 401.55 Num_heavy_atoms: 29
TPSA: 116.75 NumAromaticRings: 2

Sugarmoiety
SD00112

NCC1OC(O)C(N)C(O)C1O