Glycoside
...
GD130343

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

Formula:
C26H31O11N3

Smiles:
CNC(=N)NCc1c(C)cc2c(c1O)C(=O)c1c(OC3OC(CO)C(O)C(O)C3O)cc(OC)c(CO)c1C2=O

Aglycone:
CNC(=N)NCc1c(C)cc2c(c1O)C(=O)c1c(O)cc(OC)c(CO)c1C2=O

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

Other Identifiers

Properties
HBA: 14 RingCount: 4
HBD: 9 FractionCSP3: 0.42
AlogP: -1.6 Num_rotatable_bonds: 7
MolWt: 561.54 Num_heavy_atoms: 40
TPSA: 231.12 NumAromaticRings: 2

Unique Aglycone
AD45476
Formula: C20H21O6N3

Smiles:
CNC(=N)NCc1c(C)cc2c(c1O)C(=O)c1c(O)cc(OC)c(CO)c1C2=O
HBA: 9 RingCount: 3
HBD: 6 FractionCSP3: 0.25
AlogP: 0.93 Num_rotatable_bonds: 4
MolWt: 399.4 Num_heavy_atoms: 29
TPSA: 151.97 NumAromaticRings: 2

Sugarmoiety
SD00003

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