Name: (33R,35S,91R,92R,5S)-5-(tert-butyl)-14,14-difluoro-4,7-dioxo-2,8,10-trioxa-6-aza-1(2,3)-quinoxalina-3(3,1)-pyrrolidina-9(1,2)-cyclopentanacyclotetradecaphan-12-ene-35-carboxylic acid
Brand: TRC
SKU: TRC-D456943

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Product Overview

Product Code

TRC-D456943

CAS Number

1365970-48-4

Product Format

Neat

Molecular Formula

C29 H34 F2 N4 O7

Molecular Weight

588.6

Product Categories

TRC, Pharmaceutical Toxicology Reference Materials

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Product Information

Analyte Name

(33R,35S,91R,92R,5S)-5-(tert-butyl)-14,14-difluoro-4,7-dioxo-2,8,10-trioxa-6-aza-1(2,3)-quinoxalina-3(3,1)-pyrrolidina-9(1,2)-cyclopentanacyclotetradecaphan-12-ene-35-carboxylic acid

CAS Number

1365970-48-4

Molecular Formula

C29 H34 F2 N4 O7

Molecular Weight

588.6

Accurate Mass

588.24

SMILES

CC(C)(C)[C@@H]1NC(=O)O[C@@H]2CCC[C@H]2OCC=CC(F)(F)c3nc4ccccc4nc3O[C@@H]5C[C@H](N(C5)C1=O)C(=O)O

InChI

InChI=1S/C29H34F2N4O7/c1-28(2,3)23-25(36)35-15-16(14-19(35)26(37)38)41-24-22(32-17-8-4-5-9-18(17)33-24)29(30,31)12-7-13-40-20-10-6-11-21(20)42-27(39)34-23/h4-5,7-9,12,16,19-21,23H,6,10-11,13-15H2,1-3H3,(H,34,39)(H,37,38)/t16-,19+,20-,21-,23-/m1/s1

IUPAC

(1R,18R,22R,26S,29S)-26-tert-butyl-13,13-difluoro-24,27-dioxo-2,17,23-trioxa-4,11,25,28-tetrazapentacyclo[26.2.1.03,12.05,10.018,22]hentriaconta-3,5,7,9,11,14-hexaene-29-carboxylic acid

Storage Temperature

-20°C

Shipping Temperature

Room Temperature

Country of Origin

CANADA

Product Format

Neat

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(33R,35S,91R,92R,5S)-5-(tert-butyl)-14,14-difluoro-4,7-dioxo-2,8,10-trioxa-6-aza-1(2,3)-quinoxalina-3(3,1)-pyrrolidina-9(1,2)-cyclopentanacyclotetradecaphan-12-ene-35-carboxylic acid

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