Glycoside
...
GD129656

Name:
7-[2-(6-aminopyridin-3-yl)ethyl]-5-hydroxy-1-(hydroxymethyl)-2-methoxy-4-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}-9,10-dihydroanthracene-9,10-dione

Formula:
C29H30O11N2

Smiles:
COc1cc(OC2OC(CO)C(O)C(O)C2O)c2c(c1CO)C(=O)c1cc(CCc3ccc(=N)[nH]c3)cc(O)c1C2=O

Aglycone:
COc1cc(O)c2c(c1CO)C(=O)c1cc(CCc3ccc(=N)[nH]c3)cc(O)c1C2=O

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

Other Identifiers

Properties
HBA: 13 RingCount: 5
HBD: 8 FractionCSP3: 0.34
AlogP: -0.56 Num_rotatable_bonds: 8
MolWt: 582.56 Num_heavy_atoms: 42
TPSA: 222.85 NumAromaticRings: 3

Unique Aglycone
AD52524
Formula: C23H20O6N2

Smiles:
COc1cc(O)c2c(c1CO)C(=O)c1cc(CCc3ccc(=N)[nH]c3)cc(O)c1C2=O
HBA: 8 RingCount: 4
HBD: 5 FractionCSP3: 0.17
AlogP: 1.97 Num_rotatable_bonds: 5
MolWt: 420.42 Num_heavy_atoms: 31
TPSA: 143.7 NumAromaticRings: 3

Sugarmoiety
SD00003

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