Glycoside
...
GD120468

Name:
5-hydroxy-4-(hydroxymethyl)-6-{[3-(hydroxymethyl)phenyl]methyl}-9,10-dioxo-1-(2-phenylethenyl)-7-[(3,4,5-trihydroxy-6-methyloxan-2-yl)oxy]-9,10-dihydroanthracen-2-yl acetate

Formula:
C39H36O12

Smiles:
CC(=O)Oc1cc(CO)c2c(c1C=Cc1ccccc1)C(=O)c1cc(OC3OC(C)C(O)C(O)C3O)c(Cc3cccc(CO)c3)c(O)c1C2=O

Aglycone:
CC(=O)Oc1cc(CO)c2c(c1C=Cc1ccccc1)C(=O)c1cc(O)c(Cc3cccc(CO)c3)c(O)c1C2=O

Sugarmoiety:
CC1OC(O)C(O)C(O)C1O

Other Identifiers

Properties
HBA: 12 RingCount: 6
HBD: 6 FractionCSP3: 0.26
AlogP: 3.05 Num_rotatable_bonds: 9
MolWt: 696.71 Num_heavy_atoms: 51
TPSA: 200.28 NumAromaticRings: 4

Unique Aglycone
AD48401
Formula: C33H26O8

Smiles:
CC(=O)Oc1cc(CO)c2c(c1C=Cc1ccccc1)C(=O)c1cc(O)c(Cc3cccc(CO)c3)c(O)c1C2=O
HBA: 8 RingCount: 5
HBD: 4 FractionCSP3: 0.12
AlogP: 4.54 Num_rotatable_bonds: 7
MolWt: 550.56 Num_heavy_atoms: 41
TPSA: 141.36 NumAromaticRings: 4

Sugarmoiety
SD00076

CC1OC(O)C(O)C(O)C1O