U.S. Department of Health & Human Services Divider Arrow National Institutes of Health Divider Arrow NCATS

Details

Stereochemistry ABSOLUTE
Molecular Formula C22H28FN3O6S
Molecular Weight 481.538
Optical Activity UNSPECIFIED
Defined Stereocenters 2 / 2
E/Z Centers 1
Charge 0

SHOW SMILES / InChI
Structure of (3S,5R,6E)-7-(4-(4-FLUOROPHENYL)-6-(1-METHYLETHYL)-2-(METHYL(METHYLSULFONYL)AMINO)-5-PYRIMIDINYL)-3,5-DIHYDROXY-6-HEPTENOIC ACID

SMILES

CC(C)C1=C(\C=C\[C@H](O)C[C@H](O)CC(O)=O)C(=NC(=N1)N(C)S(C)(=O)=O)C2=CC=C(F)C=C2

InChI

InChIKey=BPRHUIZQVSMCRT-RJCHQFKYSA-N
InChI=1S/C22H28FN3O6S/c1-13(2)20-18(10-9-16(27)11-17(28)12-19(29)30)21(14-5-7-15(23)8-6-14)25-22(24-20)26(3)33(4,31)32/h5-10,13,16-17,27-28H,11-12H2,1-4H3,(H,29,30)/b10-9+/t16-,17-/m0/s1

HIDE SMILES / InChI

Approval Year

Name Type Language
(3S,5R,6E)-7-(4-(4-FLUOROPHENYL)-6-(1-METHYLETHYL)-2-(METHYL(METHYLSULFONYL)AMINO)-5-PYRIMIDINYL)-3,5-DIHYDROXY-6-HEPTENOIC ACID
Systematic Name English
ROSUVASTATIN CALCIUM IMPURITY G [EP IMPURITY]
Common Name English
6-HEPTENOIC ACID, 7-(4-(4-FLUOROPHENYL)-6-(1-METHYLETHYL)-2-(METHYL(METHYLSULFONYL)AMINO)-5-PYRIMIDINYL)-3,5-DIHYDROXY-, (3S,5R,6E)-
Systematic Name English
Code System Code Type Description
CAS
1242184-42-4
Created by admin on Sat Dec 16 14:25:13 GMT 2023 , Edited by admin on Sat Dec 16 14:25:13 GMT 2023
PRIMARY
FDA UNII
GED87J49TB
Created by admin on Sat Dec 16 14:25:13 GMT 2023 , Edited by admin on Sat Dec 16 14:25:13 GMT 2023
PRIMARY
PUBCHEM
12136803
Created by admin on Sat Dec 16 14:25:13 GMT 2023 , Edited by admin on Sat Dec 16 14:25:13 GMT 2023
PRIMARY