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Product Overview

Product Code

TRC-E933760

CAS Number

105016-65-7

Product Format

Neat

Molecular Formula

C28H28O13

Molecular Weight

572.51

API Family

Etoposide

Product Categories

Organic building blocks, Impurity Reference Materials , TRC

Product Type

Impurity, API

Documentation

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Product Information

Chemical Data

Analyte Name

Etoposide 3',4'-Quinone

CAS Number

105016-65-7

Molecular Formula

C28H28O13

Molecular Weight

572.51

Accurate Mass

572.153

SMILES

C[C@@H]1OC[C@@H]2[C@@H](O1)[C@@H]([C@H]([C@@H](O2)OC3C4COC(=O)[C@@H]4[C@@H](C5=CC6=C(C=C35)OCO6)C7=CC(=O)C(=O)C(=C7)OC)O)O

InChI

InChI=1S/C28H28O13/c1-10-35-8-19-26(39-10)23(31)24(32)28(40-19)41-25-13-6-17-16(37-9-38-17)5-12(13)20(21-14(25)7-36-27(21)33)11-3-15(29)22(30)18(4-11)34-2/h3-6,10,14,19-21,23-26,28,31-32H,7-9H2,1-2H3/t10-,14+,19-,20-,21+,23-,24-,25-,26-,28+/m1/s1

IUPAC

5-[(5S,5aR,8aR,9R)-5-[[(2R,4aR,6R,7R,8R,8aS)-7,8-dihydroxy-2-methyl-4,4a,6,7,8,8a-hexahydropyrano[3,2-d][1,3]dioxin-6-yl]oxy]-8-oxo-5a,6,8a,9-tetrahydro-5H-[2]benzofuro[6,5-f][1,3]benzodioxol-9-yl]-3-methoxycyclohexa-3,5-diene-1,2-dione

Product Data

Storage Temperature

-20°C

Shipping Temperature

Room Temperature

Country of Origin

CANADA

Product Format

Neat

Impurity Type

Intermediate

API Family

Etoposide

Product Description

Precursor to the semiquinone free radical of Etoposide, believed to inactivate -?X174 DNA.

References: Kagan, V., et al.: Biochem., 33, 9651 (1994), Gantchev, T., et al.: Mol. Pharmacol., 53, 422 (1998),

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Etoposide 3',4'-Quinone

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