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Details

Stereochemistry ABSOLUTE
Molecular Formula C37H48N4O8S
Molecular Weight 708.8665
Optical Activity UNSPECIFIED
Defined Stereocenters 4 / 4
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of SULFOLOPINAVIR

SMILES

CC(C)[C@@]([H])(C(=N[C@@]([H])(Cc1ccccc1)C[C@@]([H])([C@]([H])(Cc2ccccc2)N=C(COc3c(C)cccc3C)O)OS(=O)(=O)O)O)N4CCCN=C4O

InChI

InChIKey=NNELXDLRUHRQHW-SUGCFTRWSA-N
InChI=1S/C37H48N4O8S/c1-25(2)34(41-20-12-19-38-37(41)44)36(43)39-30(21-28-15-7-5-8-16-28)23-32(49-50(45,46)47)31(22-29-17-9-6-10-18-29)40-33(42)24-48-35-26(3)13-11-14-27(35)4/h5-11,13-18,25,30-32,34H,12,19-24H2,1-4H3,(H,38,44)(H,39,43)(H,40,42)(H,45,46,47)/t30-,31-,32-,34-/m0/s1

HIDE SMILES / InChI

Molecular Formula C37H48N4O8S
Molecular Weight 708.8665
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 4 / 4
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Created
by admin
on Sat Jun 26 07:17:07 UTC 2021
Edited
by admin
on Sat Jun 26 07:17:07 UTC 2021
Record UNII
KY3P839ICO
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
SULFOLOPINAVIR
Common Name English
LOPINAVIR IMPURITY, SULFOLOPINAVIR- [USP]
Common Name English
(2S,3S,5S)-2-(2-(2,6-DIMETHYLPHENOXY)ACETAMIDO)-5-((S)-3-METHYL-2-(2-OXOTETRAHYDROPYRIMIDIN-1(2H)-YL)BUTANAMIDO(-1,6-DIPHENYLHEXAN-3-YL HYDROGEN SULFATE
Systematic Name English
Code System Code Type Description
FDA UNII
KY3P839ICO
Created by admin on Sat Jun 26 07:17:07 UTC 2021 , Edited by admin on Sat Jun 26 07:17:07 UTC 2021
PRIMARY
PUBCHEM
76969994
Created by admin on Sat Jun 26 07:17:07 UTC 2021 , Edited by admin on Sat Jun 26 07:17:07 UTC 2021
PRIMARY
Related Record Type Details
PARENT -> IMPURITY
CHROMATOGRAPHIC PURITY (HPLC/UV)
USP