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Details

Stereochemistry ABSOLUTE
Molecular Formula C33H33FN2O5
Molecular Weight 556.6239
Optical Activity UNSPECIFIED
Defined Stereocenters 1 / 1
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of (5R)-7-[2-(4-fluorophenyl)-3-phenyl-4-(phenylcarbamoyl)-5-(propan-2-yl)-1H-pyrrol-1-yl]-5-hydroxy-3-oxoheptanoic acid

SMILES

[H][C@@](O)(CCN1C(C(C)C)=C(C(=O)NC2=CC=CC=C2)C(=C1C3=CC=C(F)C=C3)C4=CC=CC=C4)CC(=O)CC(O)=O

InChI

InChIKey=JVFCMPKBFPIOON-AREMUKBSSA-N
InChI=1S/C33H33FN2O5/c1-21(2)31-30(33(41)35-25-11-7-4-8-12-25)29(22-9-5-3-6-10-22)32(23-13-15-24(34)16-14-23)36(31)18-17-26(37)19-27(38)20-28(39)40/h3-16,21,26,37H,17-20H2,1-2H3,(H,35,41)(H,39,40)/t26-/m1/s1

HIDE SMILES / InChI

Molecular Formula C33H33FN2O5
Molecular Weight 556.6239
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 1 / 1
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Created
by admin
on Sat Dec 16 19:16:40 GMT 2023
Edited
by admin
on Sat Dec 16 19:16:40 GMT 2023
Record UNII
EQT8KV5V2M
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
(5R)-7-[2-(4-fluorophenyl)-3-phenyl-4-(phenylcarbamoyl)-5-(propan-2-yl)-1H-pyrrol-1-yl]-5-hydroxy-3-oxoheptanoic acid
Systematic Name English
ATORVASTATIN CALCIUM IMPURITY O [EP IMPURITY]
Common Name English
1H-Pyrrole-1-heptanoic acid, 2-(4-fluorophenyl)-δ-hydroxy-5-(1-methylethyl)-β-oxo-3-phenyl-4-[(phenylamino)carbonyl]-, (δR)-
Systematic Name English
(δR)-2-(4-Fluorophenyl)-δ-hydroxy-5-(1-methylethyl)-β-oxo-3-phenyl-4-[(phenylamino)carbonyl]-1H-pyrrole-1-heptanoic acid
Systematic Name English
Code System Code Type Description
FDA UNII
EQT8KV5V2M
Created by admin on Sat Dec 16 19:16:40 GMT 2023 , Edited by admin on Sat Dec 16 19:16:40 GMT 2023
PRIMARY
PUBCHEM
57831777
Created by admin on Sat Dec 16 19:16:40 GMT 2023 , Edited by admin on Sat Dec 16 19:16:40 GMT 2023
PRIMARY
CAS
887196-30-7
Created by admin on Sat Dec 16 19:16:40 GMT 2023 , Edited by admin on Sat Dec 16 19:16:40 GMT 2023
PRIMARY
Related Record Type Details
PARENT -> IMPURITY