Glycoside
...
GD153517

Name:
N'-{[3-cyclopentyl-1-hydroxy-5-(hydroxymethyl)-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:
C30H37O11N3

Smiles:
CNC(=N)NCc1c(C2CCCC2)cc2c(c1O)C(=O)c1c(OC3OC(CO)C(O)C(O)C3O)cc(OC)c(CO)c1C2=O

Aglycone:
CNC(=N)NCc1c(C2CCCC2)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: 5
HBD: 9 FractionCSP3: 0.5
AlogP: -0.25 Num_rotatable_bonds: 8
MolWt: 615.64 Num_heavy_atoms: 44
TPSA: 231.12 NumAromaticRings: 2

Unique Aglycone
AD61051
Formula: C24H27O6N3

Smiles:
CNC(=N)NCc1c(C2CCCC2)cc2c(c1O)C(=O)c1c(O)cc(OC)c(CO)c1C2=O
HBA: 9 RingCount: 4
HBD: 6 FractionCSP3: 0.38
AlogP: 2.28 Num_rotatable_bonds: 5
MolWt: 453.5 Num_heavy_atoms: 33
TPSA: 151.97 NumAromaticRings: 2

Sugarmoiety
SD00003

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