Product Code

TRC-A791903

CAS Number

363599-71-7

Product Format

Neat

Molecular Formula

2 C33 H35 F N2 O5 . Ca . 2 H

Molecular Weight

1159.373

Product Categories

TRC, Impurity Reference Materials , Pharmaceutical Toxicology Reference Materials , API Reference Standards & Research Materials

Product Type

API

Alternate CAS Number

110862-48-1

Price and availability

48-hour USA dispatch time

Freight restricted.

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Product Information

Chemical Data

Analyte Name

rac-Atorvastatin Calcium

CAS Number

363599-71-7

Molecular Formula

2 C33 H35 F N2 O5 . Ca . 2 H

Molecular Weight

1159.373

Accurate Mass

1158.484

SMILES

[Ca].CC(C)c1c(C(=O)Nc2ccccc2)c(c3ccccc3)c(c4ccc(F)cc4)n1CC[C@@H](O)C[C@@H](O)CC(=O)O.CC(C)c5c(C(=O)Nc6ccccc6)c(c7ccccc7)c(c8ccc(F)cc8)n5CC[C@@H](O)C[C@@H](O)CC(=O)O

InChI

InChI=1S/2C33H35FN2O5.Ca.2H/c2*1-21(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;;;/h2*3-16,21,26-27,37-38H,17-20H2,1-2H3,(H,35,41)(H,39,40);;;/t2*26-,27-;;;/m11.../s1

IUPAC

calcium dihydride;(3R,5R)-7-[2-(4-fluorophenyl)-3-phenyl-4-(phenylcarbamoyl)-5-propan-2-ylpyrrol-1-yl]-3,5-dihydroxyheptanoic acid;hydrogen

Alternate CAS Number

110862-48-1

Product Data

Storage Temperature

-20°C

Shipping Temperature

Room Temperature

Country of Origin

CANADA

Product Format

Neat

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rac-Atorvastatin Calcium

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