Glycoside
...
GD157957

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

Formula:
C41H38O11N2

Smiles:
CC(=O)Oc1cc(CO)c2c(c1-c1ccc3ccccc3c1)C(=O)c1cc(OC3OC(C)C(O)C(O)C3O)c(Cc3cccc(C(N)N)c3)c(O)c1C2=O

Aglycone:
CC(=O)Oc1cc(CO)c2c(c1-c1ccc3ccccc3c1)C(=O)c1cc(O)c(Cc3cccc(C(N)N)c3)c(O)c1C2=O

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

Other Identifiers

Properties
HBA: 13 RingCount: 7
HBD: 9 FractionCSP3: 0.24
AlogP: 3.12 Num_rotatable_bonds: 8
MolWt: 734.76 Num_heavy_atoms: 54
TPSA: 232.09 NumAromaticRings: 5

Unique Aglycone
AD51256
Formula: C35H28O7N2

Smiles:
CC(=O)Oc1cc(CO)c2c(c1-c1ccc3ccccc3c1)C(=O)c1cc(O)c(Cc3cccc(C(N)N)c3)c(O)c1C2=O
HBA: 9 RingCount: 6
HBD: 7 FractionCSP3: 0.11
AlogP: 4.62 Num_rotatable_bonds: 6
MolWt: 588.62 Num_heavy_atoms: 44
TPSA: 173.17 NumAromaticRings: 5

Sugarmoiety
SD00076

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