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Alfa Omega Pharma specialize in the custom synthesis of milligram to gram quantities of stable isotope labelled materials, metabolites and impurity standards. We offer synthesis services to the pharmaceutical bio analytical departments of CROs and related industries. Our focus is to serve the industries involved and working towards global healthcare


 

Atorvastatin-D5 Calcium

Atorvastatin-D5 Calcium
Atorvastatin-D5 Calcium
Category: In House
Product Code: A00115
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Atorvastatin-D5 Calcium

Compound Information

Pub Chem ID 45038178

Descriptons

IUPAC Name: 5-(4-fluorophenyl)-1-[2-[(2R,4R)-4-hydroxy-6-oxooxan-2-yl]ethyl]-4-(2,3,
4,5,6-pentadeuteriophenyl)-N-phenyl-2-propan-2-ylpyrrole-3-carboxamide

InChI: InChI=1S/C33H33FN2O4/c1-21(2)31-30(33(39)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)18-17-27-19-26(37)20-28(38)
40-27/h3-16,21,26-27,37H,17-20H2,1-2H3,(H,35,39)/t26-,27-/m1/s1/i3D,5D,
6D,9D,10D

InChIKey: OUCSEDFVYPBLLF-CCJPLZOUSA-N

Canonical SMILES : CC(C)C1=C(C(=C(N1CCC2CC(CC(=O)O2)O)C3=CC=C(C=C3)F)C4=CC=CC=C4)C(=O)NC5=
CC=CC=C5

Isomeric SMILES: [2H]C1=C(C(=C(C(=C1[2H])[2H])C2=C(N(C(=C2C(=O)NC3=CC=CC=C3)C(C)C)CC[C@@
H]4C[C@H](CC(=O)O4)O)C5=CC=C(C=C5)F)[2H])[2H]

Atorvastatin-D5 Calcium

Molecular Formula
Molecular formula 16GB
Physical Properties
Appearence 4

Description

Atorvastatin-D5 Calcium

Compound Information

Pub Chem ID 45038178

Descriptons

IUPAC Name: 5-(4-fluorophenyl)-1-[2-[(2R,4R)-4-hydroxy-6-oxooxan-2-yl]ethyl]-4-(2,3,
4,5,6-pentadeuteriophenyl)-N-phenyl-2-propan-2-ylpyrrole-3-carboxamide

InChI: InChI=1S/C33H33FN2O4/c1-21(2)31-30(33(39)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)18-17-27-19-26(37)20-28(38)
40-27/h3-16,21,26-27,37H,17-20H2,1-2H3,(H,35,39)/t26-,27-/m1/s1/i3D,5D,
6D,9D,10D

InChIKey: OUCSEDFVYPBLLF-CCJPLZOUSA-N

Canonical SMILES : CC(C)C1=C(C(=C(N1CCC2CC(CC(=O)O2)O)C3=CC=C(C=C3)F)C4=CC=CC=C4)C(=O)NC5=
CC=CC=C5

Isomeric SMILES: [2H]C1=C(C(=C(C(=C1[2H])[2H])C2=C(N(C(=C2C(=O)NC3=CC=CC=C3)C(C)C)CC[C@@
H]4C[C@H](CC(=O)O4)O)C5=CC=C(C=C5)F)[2H])[2H]

Atorvastatin-D5 Calcium

Specification

Molecular Formula
Molecular formula 16GB
Physical Properties
Appearence 4

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