Glycoside
...
GD144418

Name:
N'-({3-[2-(6-aminopyridin-3-yl)ethyl]-1-hydroxy-6-methoxy-9,10-dioxo-8-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}-9,10-dihydroanthracen-2-yl}methyl)-N-methylguanidine

Formula:
C31H35O10N5

Smiles:
CNC(=N)NCc1c(CCc2ccc(=N)[nH]c2)cc2c(c1O)C(=O)c1c(OC3OC(CO)C(O)C(O)C3O)cc(OC)cc1C2=O

Aglycone:
CNC(=N)NCc1c(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: 15 RingCount: 5
HBD: 10 FractionCSP3: 0.35
AlogP: -0.81 Num_rotatable_bonds: 9
MolWt: 637.65 Num_heavy_atoms: 46
TPSA: 250.53 NumAromaticRings: 3

Unique Aglycone
AD46548
Formula: C25H25O5N5

Smiles:
CNC(=N)NCc1c(CCc2ccc(=N)[nH]c2)cc2c(c1O)C(=O)c1c(O)cc(OC)cc1C2=O
HBA: 10 RingCount: 4
HBD: 7 FractionCSP3: 0.2
AlogP: 1.72 Num_rotatable_bonds: 6
MolWt: 475.51 Num_heavy_atoms: 35
TPSA: 171.38 NumAromaticRings: 3

Sugarmoiety
SD00003

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