Glycoside
...
GD040404

Name:
~{n}-[(2~{r},3~{r},4~{r},5~{s},6~{r})-5-[(2~{s},3~{r},4~{s},5~{s},6~{r})-4-[[1-[[3-(3-azanylprop-1-ynyl)phenyl]methyl]-1,2,3-triazol-4-yl]methoxy]-6-(hydroxymethyl)-3,5-bis(oxidanyl)oxan-2-yl]oxy-6-(hydroxymethyl)-4-oxidanyl-2-propoxy-oxan-3-yl]ethanamide

Formula:
C30H43O11N5

Smiles:
CCCO[C@H]1O[C@H](CO)[C@H](O[C@H]2O[C@H](CO)[C@H](O)[C@H](OCc3cn(Cc4cccc(C#CCN)c4)nn3)[C@@H]2O)[C@H](O)[C@@H]1NC(C)=O

Aglycone:
NCC#Cc1cccc(Cn2cc(CO)nn2)c1

Sugarmoiety:
CCCOC1OC(CO)C(OC2OC(CO)C(O)C(O)C2O)C(O)C1NC(C)=O

Other Identifiers

Properties
HBA: 16 RingCount: 4
HBD: 8 FractionCSP3: 0.63
AlogP: -2.64 Num_rotatable_bonds: 13
MolWt: 649.7 Num_heavy_atoms: 46
TPSA: 233.13 NumAromaticRings: 2

Unique Aglycone
AD24756
Formula: C13H14ON4

Smiles:
NCC#Cc1cccc(Cn2cc(CO)nn2)c1
HBA: 5 RingCount: 2
HBD: 3 FractionCSP3: 0.23
AlogP: 0.13 Num_rotatable_bonds: 3
MolWt: 242.28 Num_heavy_atoms: 18
TPSA: 76.96 NumAromaticRings: 2

Sugarmoiety
SD03346

CCCOC1OC(CO)C(OC2OC(CO)C(O)C(O)C2O)C(O)C1NC(C)=O