Glycoside
...
GD038002

Name:
(2r,3r)-4-[(2r)-2-(3-chlorophenyl)pyrrolidin-1-yl]-2,3-dihydroxy-4-oxo-n-[(5-{[2-(trifluoromethyl)-1h-benzimidazol-1-yl]methyl}thiophen-2-yl)methyl]butanamide

Formula:
C29H26O4N4F3ClS

Smiles:
O=C(NCc1ccc(Cn2c(C(F)(F)F)nc3ccccc32)s1)[C@@H](O)[C@@H](O)C(=O)N1CCC[C@H]1c1cccc(Cl)c1

Aglycone:
Clc1cccc(C2CCCN2)c1.NCc1ccc(Cn2c(C(F)(F)F)nc3ccccc32)s1

Sugarmoiety:
O=C(O)C(O)C(O)C(=O)O

Other Identifiers

Properties
HBA: 8 RingCount: 5
HBD: 3 FractionCSP3: 0.32
AlogP: 4.52 Num_rotatable_bonds: 8
MolWt: 607.05 Num_heavy_atoms: 41
TPSA: 107.69 NumAromaticRings: 4

Unique Aglycone
AD04593
Formula: C11H12NCl

Smiles:
Clc1cccc(C2CCCN2)c1
HBA: 1 RingCount: 2
HBD: 1 FractionCSP3: 0.4
AlogP: 2.76 Num_rotatable_bonds: 1
MolWt: 181.67 Num_heavy_atoms: 12
TPSA: 12.03 NumAromaticRings: 1
AD16323
Formula: C14H12N3F3S

Smiles:
NCc1ccc(Cn2c(C(F)(F)F)nc3ccccc32)s1
HBA: 3 RingCount: 3
HBD: 2 FractionCSP3: 0.21
AlogP: 3.62 Num_rotatable_bonds: 3
MolWt: 311.33 Num_heavy_atoms: 21
TPSA: 43.84 NumAromaticRings: 3

Sugarmoiety
SD00169

O=C(O)C(O)C(O)C(=O)O