Glycoside
...
GD132555

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

Formula:
C32H35O10N3

Smiles:
N=C(N)NCc1c(CCc2ccccc2)c2c(c(OCCO)c1OC1OC(CO)C(O)C(O)C1O)C(=O)c1ccccc1C2=O

Aglycone:
N=C(N)NCc1c(O)c(OCCO)c2c(c1CCc1ccccc1)C(=O)c1ccccc1C2=O

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

Other Identifiers

Properties
HBA: 13 RingCount: 5
HBD: 9 FractionCSP3: 0.34
AlogP: -0.22 Num_rotatable_bonds: 11
MolWt: 621.64 Num_heavy_atoms: 45
TPSA: 224.88 NumAromaticRings: 3

Unique Aglycone
AD53671
Formula: C26H25O5N3

Smiles:
N=C(N)NCc1c(O)c(OCCO)c2c(c1CCc1ccccc1)C(=O)c1ccccc1C2=O
HBA: 8 RingCount: 4
HBD: 6 FractionCSP3: 0.19
AlogP: 2.31 Num_rotatable_bonds: 8
MolWt: 459.5 Num_heavy_atoms: 34
TPSA: 145.73 NumAromaticRings: 3

Sugarmoiety
SD00003

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