Glycoside
...
GD153179

Name:
5-hydroxy-6-{[3-(hydroxymethyl)phenyl]methyl}-9,10-dioxo-8-[(1H-pyrrol-3-yl)methyl]-7-[(3,4,5-trihydroxy-6-methyloxan-2-yl)oxy]-9,10-dihydroanthracen-2-yl acetate

Formula:
C35H33O11N

Smiles:
CC(=O)Oc1ccc2c(c1)C(=O)c1c(Cc3cc[nH]c3)c(OC3OC(C)C(O)C(O)C3O)c(Cc3cccc(CO)c3)c(O)c1C2=O

Aglycone:
CC(=O)Oc1ccc2c(c1)C(=O)c1c(Cc3cc[nH]c3)c(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: 0.29
AlogP: 2.3 Num_rotatable_bonds: 8
MolWt: 643.65 Num_heavy_atoms: 47
TPSA: 195.84 NumAromaticRings: 4

Unique Aglycone
AD60943
Formula: C29H23O7N

Smiles:
CC(=O)Oc1ccc2c(c1)C(=O)c1c(Cc3cc[nH]c3)c(O)c(Cc3cccc(CO)c3)c(O)c1C2=O
HBA: 8 RingCount: 5
HBD: 4 FractionCSP3: 0.14
AlogP: 3.8 Num_rotatable_bonds: 6
MolWt: 497.5 Num_heavy_atoms: 37
TPSA: 136.92 NumAromaticRings: 4

Sugarmoiety
SD00076

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