Glycoside
...
GD127198

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

Formula:
C42H42O13

Smiles:
CC(=O)Oc1cc(CO)c2c(c1C=Cc1cccc(CCCO)c1)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=Cc1cccc(CCCO)c1)C(=O)c1cc(O)c(Cc3cccc(CO)c3)c(O)c1C2=O

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

Other Identifiers

Properties
HBA: 13 RingCount: 6
HBD: 7 FractionCSP3: 0.31
AlogP: 2.97 Num_rotatable_bonds: 12
MolWt: 754.79 Num_heavy_atoms: 55
TPSA: 220.51 NumAromaticRings: 4

Unique Aglycone
AD51502
Formula: C36H32O9

Smiles:
CC(=O)Oc1cc(CO)c2c(c1C=Cc1cccc(CCCO)c1)C(=O)c1cc(O)c(Cc3cccc(CO)c3)c(O)c1C2=O
HBA: 9 RingCount: 5
HBD: 5 FractionCSP3: 0.19
AlogP: 4.47 Num_rotatable_bonds: 10
MolWt: 608.64 Num_heavy_atoms: 45
TPSA: 161.59 NumAromaticRings: 4

Sugarmoiety
SD00076

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