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Product Overview

Product Code

TRC-N388750

CAS Number

1354235-96-3

Product Format

Neat

Molecular Formula

C30H31FN4O3

Molecular Weight

514.59

Product Categories

Pharmaceutical Reference Standards, TRC, Enzyme inhibitors, Agonist & antagonist analogues, Calcium Channel, Epilepsy, Parkinson's, Stroke

Product Type

Bioactive Small Molecule

Alternate CAS Number

Relative stereochemistry: 1137263-70-7

Documentation

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Product Information

Chemical Data

Analyte Name

trans-Ned-19

CAS Number

1354235-96-3

Molecular Formula

C30H31FN4O3

Molecular Weight

514.59

Accurate Mass

514.238

SMILES

COC1=C(C=C(C=C1)[C@@H]2C3=C(C[C@H](N2)C(=O)O)C4=CC=CC=C4N3)CN5CCN(CC5)C6=CC=CC=C6F

InChI

InChI=1S/C30H31FN4O3/c1-38-27-11-10-19(16-20(27)18-34-12-14-35(15-13-34)26-9-5-3-7-23(26)31)28-29-22(17-25(33-28)30(36)37)21-6-2-4-8-24(21)32-29/h2-11,16,25,28,32-33H,12-15,17-18H2,1H3,(H,36,37)/t25-,28+/m0/s1

IUPAC

(1R,3S)-1-[3-[[4-(2-fluorophenyl)piperazin-1-yl]methyl]-4-methoxyphenyl]-2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indole-3-carboxylic acid

Alternate CAS Number

Relative stereochemistry: 1137263-70-7

Product Data

Storage Temperature

+4°C

Shipping Temperature

Room Temperature

Country of Origin

CANADA

Product Format

Neat

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