Name: (1S,2S,3S,5S)-5-[2-[[(4-Methoxyphenyl)diphenylmethyl]amino]-6-(phenylmethoxy)-9H-purin-9-yl]-3-(phenylmethoxy)-2-[(phenylmethoxy)methyl]cyclopentanol
Brand: Mikromol
SKU: MM3314.14-0025

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Product Overview

Product Code

MM3314.14-0025

CAS Number

142217-78-5

Product Format

Neat

Molecular Formula

C52 H49 N5 O5

Molecular Weight

823.976

API Family

Entecavir Monohydrate

Product Categories

Impurity Reference Materials , Antivirals and antiretrovirals, Mikromol

Product Type

Impurity

Drug Type

Antivirals

Documentation

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Product Information

Analyte Data

Analyte Name

Entecavir-5

CAS Number

142217-78-5

Molecular Formula

C52 H49 N5 O5

Molecular Weight

823.976

Accurate Mass

823.373

SMILES

COc1ccc(cc1)C(Nc2nc(OCc3ccccc3)c4ncn([C@H]5C[C@H](OCc6ccccc6)[C@@H](COCc7ccccc7)[C@@H]5O)c4n2)(c8ccccc8)c9ccccc9

InChI

InChI=1S/C52H49N5O5/c1-59-43-29-27-42(28-30-43)52(40-23-13-5-14-24-40,41-25-15-6-16-26-41)56-51-54-49-47(50(55-51)62-34-39-21-11-4-12-22-39)53-36-57(49)45-31-46(61-33-38-19-9-3-10-20-38)44(48(45)58)35-60-32-37-17-7-2-8-18-37/h2-30,36,44-46,48,58H,31-35H2,1H3,(H,54,55,56)/t44-,45+,46+,48+/m1/s1

IUPAC

(1S,2S,3S,5S)-5-[2-[[(4-methoxyphenyl)-diphenylmethyl]amino]-6-phenylmethoxypurin-9-yl]-3-phenylmethoxy-2-(phenylmethoxymethyl)cyclopentan-1-ol

Product Data

Storage Temperature

+5°C

Shipping Temperature

Room Temperature

Country of Origin

GERMANY

Product Format

Neat

Impurity Type

Intermediate

API Family

Entecavir Monohydrate

Product citations

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At Mikromol, we go beyond the standard to produce high-quality, globally relevant pharmaceutical reference standards that you can trust. For more than 25 years we have delivered quality reference standards for analytical development, method validation, and stability and release testing to customers around the world.

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(1S,2S,3S,5S)-5-[2-[[(4-Methoxyphenyl)diphenylmethyl]amino]-6-(phenylmethoxy)-9H-purin-9-yl]-3-(phenylmethoxy)-2-[(phenylmethoxy)methyl]cyclopentanol

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