Glycoside
...
GD145148

Name:
6-ethyl-12-[(4-{[(4-ethynylphenyl)methyl](methyl)amino}-3-hydroxy-6-methyloxan-2-yl)oxy]-4,5-dihydroxy-10-[(5-hydroxy-4-methoxy-4,6-dimethyloxan-2-yl)oxy]-3,5,9,11,13-pentamethyl-7,14-dioxabicyclo[11.2.1]hexadecane-2,8-dione

Formula:
C45H69O13N

Smiles:
C#Cc1ccc(CN(C)C2CC(C)OC(OC3C(C)C(OC4CC(C)(OC)C(O)C(C)O4)C(C)C(=O)OC(CC)C(C)(O)C(O)C(C)C(=O)C4COC3(C)C4)C2O)cc1

Aglycone:
C#Cc1ccc(CN(C)C2CC(C)OC(OC3C(C)C(O)C(C)C(=O)OC(CC)C(C)(O)C(O)C(C)C(=O)C4COC3(C)C4)C2O)cc1

Sugarmoiety:
COC1(C)CC(O)OC(C)C1O

Other Identifiers

Properties
HBA: 14 RingCount: 5
HBD: 4 FractionCSP3: 0.78
AlogP: 3.36 Num_rotatable_bonds: 9
MolWt: 832.04 Num_heavy_atoms: 59
TPSA: 182.91 NumAromaticRings: 1

Unique Aglycone
AD58280
Formula: C37H55O10N

Smiles:
C#Cc1ccc(CN(C)C2CC(C)OC(OC3C(C)C(O)C(C)C(=O)OC(CC)C(C)(O)C(O)C(C)C(=O)C4COC3(C)C4)C2O)cc1
HBA: 11 RingCount: 4
HBD: 4 FractionCSP3: 0.73
AlogP: 2.43 Num_rotatable_bonds: 6
MolWt: 673.84 Num_heavy_atoms: 48
TPSA: 155.22 NumAromaticRings: 1

Sugarmoiety
SD00005

COC1(C)CC(O)OC(C)C1O