Glycoside
...
GD130999

Name:
N'-[(3-cyclohexyl-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:
C30H37O10N3

Smiles:
CNC(=N)NCc1c(C2CCCCC2)cc2c(c1O)C(=O)c1c(OC3OC(CO)C(O)C(O)C3O)cc(OC)cc1C2=O

Aglycone:
CNC(=N)NCc1c(C2CCCCC2)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: 0.5
AlogP: 0.65 Num_rotatable_bonds: 7
MolWt: 599.64 Num_heavy_atoms: 43
TPSA: 210.89 NumAromaticRings: 2

Unique Aglycone
AD53087
Formula: C24H27O5N3

Smiles:
CNC(=N)NCc1c(C2CCCCC2)cc2c(c1O)C(=O)c1c(O)cc(OC)cc1C2=O
HBA: 8 RingCount: 4
HBD: 5 FractionCSP3: 0.38
AlogP: 3.17 Num_rotatable_bonds: 4
MolWt: 437.5 Num_heavy_atoms: 32
TPSA: 131.74 NumAromaticRings: 2

Sugarmoiety
SD00003

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