AC1O52NX structure

AC1O52NX

N-[2-chloro-1-(3,4,5-trihydroxy-6-methylsulfanyloxan-2-yl)propyl]-1-ethyl-4-propylpyrrolidine-2-carboxamide

Also Known As: L-THREO-ALPHA-D-GALACTO-OCTOPYRANOSIDE, DERIVATI|Methyl 7-chloro-6,7,8-trideoxy-6-[(1-ethyl-4-propylprolyl)amino]-1-thiooctopyranoside|N-[2-chloro-1-(3,4,5-trihydroxy-6-methylsulfanyloxan-2-yl)propyl]-1-ethyl-4-propylpyrrolidine-2-carboxamide

CAS: 13441-66-2
Molecular Formula C19H35ClN2O5S
Molecular Weight 438.19553 g/mol
LogP 0.7796
Topological Polar Surface Area 102.26 Ų
Hydrogen Bond Donors 4
Hydrogen Bond Acceptors 7
Rotatable Bonds 8
Exact Mass 438.19553
Monoisotopic Mass 438.19553
Heavy Atoms 28
Complexity 512.71564

Chemical Identifiers

CAS Number 13441-66-2
SMILES CCCC1CC(N(C1)CC)C(=O)NC(C2C(C(C(C(O2)SC)O)O)O)C(C)Cl

Product Overview

AC1O52NX (CAS 13441-66-2), with molecular formula C19H35ClN2O5S and molecular weight 438.19553 g/mol. IUPAC: N-[2-chloro-1-(3,4,5-trihydroxy-6-methylsulfanyloxan-2-yl)propyl]-1-ethyl-4-propylpyrrolidine-2-carboxamide.

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