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Product Overview

Product Code

TLCS-1240

CAS Number

79902-42-4

EP Description

Simvastatin Impurity I

Product Format

Neat

Molecular Formula

C23 H34 O5

Molecular Weight

390.51

API Family

Simvastatin

Product Categories

Impurity Reference Materials

Product Type

Impurity

Drug Type

Antihyperlipidemics

Documentation

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Product Information

Analyte Name

2'-Desethyl Simvastatin

CAS Number

79902-42-4

Molecular Formula

C23 H34 O5

Molecular Weight

390.51

Accurate Mass

390.2406

SMILES

CC(C)C(=O)O[C@H]1C[C@@H](C)C=C2C=C[C@H](C)[C@H](CC[C@@H]3C[C@@H](O)CC(=O)O3)[C@@H]12

InChI

InChI=1S/C23H34O5/c1-13(2)23(26)28-20-10-14(3)9-16-6-5-15(4)19(22(16)20)8-7-18-11-17(24)12-21(25)27-18/h5-6,9,13-15,17-20,22,24H,7-8,10-12H2,1-4H3/t14-,15-,17+,18+,19-,20-,22-/m0/s1

IUPAC

[(1S,3R,7S,8S,8aR)-8-[2-[(2R,4R)-4-hydroxy-6-oxooxan-2-yl]ethyl]-3,7-dimethyl-1,2,3,7,8,8a-hexahydronaphthalen-1-yl] 2-methylpropanoate

Country of Origin

CANADA

Product Type

Impurity

Product Format

Neat

API Family

Simvastatin

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