Glycoside
...
GD135539

Name:
3-[2-(6-aminopyridin-3-yl)ethyl]-1-hydroxy-6-methoxy-2-[(methylamino)methyl]-8-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}-9,10-dihydroanthracene-9,10-dione

Formula:
C30H33O10N3

Smiles:
CNCc1c(CCc2ccc(=N)[nH]c2)cc2c(c1O)C(=O)c1c(OC3OC(CO)C(O)C(O)C3O)cc(OC)cc1C2=O

Aglycone:
CNCc1c(CCc2ccc(=N)[nH]c2)cc2c(c1O)C(=O)c1c(O)cc(OC)cc1C2=O

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

Other Identifiers

Properties
HBA: 13 RingCount: 5
HBD: 8 FractionCSP3: 0.37
AlogP: -0.33 Num_rotatable_bonds: 9
MolWt: 595.61 Num_heavy_atoms: 43
TPSA: 214.65 NumAromaticRings: 3

Unique Aglycone
AD54803
Formula: C24H23O5N3

Smiles:
CNCc1c(CCc2ccc(=N)[nH]c2)cc2c(c1O)C(=O)c1c(O)cc(OC)cc1C2=O
HBA: 8 RingCount: 4
HBD: 5 FractionCSP3: 0.21
AlogP: 2.19 Num_rotatable_bonds: 6
MolWt: 433.46 Num_heavy_atoms: 32
TPSA: 135.5 NumAromaticRings: 3

Sugarmoiety
SD00003

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