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Details

Stereochemistry ABSOLUTE
Molecular Formula C22H26FN3O6S
Molecular Weight 479.522
Optical Activity UNSPECIFIED
Defined Stereocenters 1 / 1
E/Z Centers 1
Charge 0

SHOW SMILES / InChI
Structure of (3R,6E)-7-(4-(4-FLUOROPHENYL)-6-(1-METHYLETHYL)-2-(METHYL(METHYLSULFONYL)AMINO)PYRIMIDIN-5-YL)-3-HYDROXY-5-OXOHEPT-6-ENOIC ACID

SMILES

CC(C)C1=C(\C=C\C(=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=SGVASDMKSZUTTN-OAGJVSPASA-N
InChI=1S/C22H26FN3O6S/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/h5-10,13,17,28H,11-12H2,1-4H3,(H,29,30)/b10-9+/t17-/m1/s1

HIDE SMILES / InChI

Molecular Formula C22H26FN3O6S
Molecular Weight 479.522
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 1 / 1
E/Z Centers 1
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Created
by admin
on Sat Dec 16 14:32:28 GMT 2023
Edited
by admin
on Sat Dec 16 14:32:28 GMT 2023
Record UNII
1A3WU50C5Q
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
(3R,6E)-7-(4-(4-FLUOROPHENYL)-6-(1-METHYLETHYL)-2-(METHYL(METHYLSULFONYL)AMINO)PYRIMIDIN-5-YL)-3-HYDROXY-5-OXOHEPT-6-ENOIC ACID
Systematic Name English
6-HEPTENOIC ACID, 7-(4-(4-FLUOROPHENYL)-6-(1-METHYLETHYL)-2-(METHYL(METHYLSULFONYL)AMINO)-5-PYRIMIDINYL)-3-HYDROXY-5-OXO-, (3R,6E)-
Systematic Name English
(R,E)-7-(4-(4-FLUOROPHENYL)-6-ISOPROPYL-2-(N-METHYLMETHYLSULFONAMIDO)PYRIMIDIN-5-YL)-3-HYDROXY-5-OXOHEPT-6-ENOIC ACID
Systematic Name English
ROSUVASTATIN CALCIUM IMPURITY C [EP IMPURITY]
Common Name English
ROSUVASTATIN KETONE [USP IMPURITY]
Common Name English
Code System Code Type Description
PUBCHEM
67025025
Created by admin on Sat Dec 16 14:32:29 GMT 2023 , Edited by admin on Sat Dec 16 14:32:29 GMT 2023
PRIMARY
RS_ITEM_NUM
1A00050
Created by admin on Sat Dec 16 14:32:29 GMT 2023 , Edited by admin on Sat Dec 16 14:32:29 GMT 2023
PRIMARY
CAS
1422619-13-3
Created by admin on Sat Dec 16 14:32:29 GMT 2023 , Edited by admin on Sat Dec 16 14:32:29 GMT 2023
PRIMARY
FDA UNII
1A3WU50C5Q
Created by admin on Sat Dec 16 14:32:29 GMT 2023 , Edited by admin on Sat Dec 16 14:32:29 GMT 2023
PRIMARY
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