Glycoside
...
GD131598

Name:
7-chloro-4-(dimethylamino)-3,4a,10,12,12a-pentahydroxy-6-[(4-hydroxy-5-methoxy-4,6-dimethyloxan-2-yl)oxy]-8-methoxy-6-methyl-1,11-dioxo-1,4,4a,5,5a,6,11,12a-octahydrotetracene-2-carboxamide

Formula:
C32H39O13N2Cl

Smiles:
COc1cc(O)c2c(c1Cl)C(C)(OC1CC(C)(O)C(OC)C(C)O1)C1CC3(O)C(N(C)C)C(O)=C(C(=N)O)C(=O)C3(O)C(O)=C1C2=O

Aglycone:
COc1cc(O)c2c(c1Cl)C(C)(O)C1CC3(O)C(N(C)C)C(O)=C(C(=N)O)C(=O)C3(O)C(O)=C1C2=O

Sugarmoiety:
COC1C(C)OC(O)CC1(C)O

Other Identifiers

Properties
HBA: 15 RingCount: 5
HBD: 8 FractionCSP3: 0.58
AlogP: 1.54 Num_rotatable_bonds: 6
MolWt: 683.11 Num_heavy_atoms: 47
TPSA: 239.76 NumAromaticRings: 1

Unique Aglycone
AD53305
Formula: C24H25O10N2Cl

Smiles:
COc1cc(O)c2c(c1Cl)C(C)(O)C1CC3(O)C(N(C)C)C(O)=C(C(=N)O)C(=O)C3(O)C(O)=C1C2=O
HBA: 12 RingCount: 4
HBD: 8 FractionCSP3: 0.43
AlogP: 0.61 Num_rotatable_bonds: 3
MolWt: 524.91 Num_heavy_atoms: 36
TPSA: 212.07 NumAromaticRings: 1

Sugarmoiety
SD07387

COC1C(C)OC(O)CC1(C)O