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Product Overview

Product Code

TRC-C696370

CAS Number

73499-12-4

Product Format

Neat

Molecular Formula

C32H35NO8

Molecular Weight

561.62

Product Categories

TRC, Pharmaceutical Toxicology Reference Materials

Product Type

Bioactive Small Molecule

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Product Information

Chemical Data

Analyte Name

Cortisol 21-m-Maleimidobenzoate

CAS Number

73499-12-4

Molecular Formula

C32H35NO8

Molecular Weight

561.62

Accurate Mass

561.2363

SMILES

C[C@]12CCC(=O)C=C1CC[C@H]3[C@@H]4CC[C@](O)(C(=O)COC(=O)c5cccc(c5)N6C(=O)C=CC6=O)[C@@]4(C)C[C@H](O)[C@H]23

InChI

InChI=1S/C32H35NO8/c1-30-12-10-21(34)15-19(30)6-7-22-23-11-13-32(40,31(23,2)16-24(35)28(22)30)25(36)17-41-29(39)18-4-3-5-20(14-18)33-26(37)8-9-27(33)38/h3-5,8-9,14-15,22-24,28,35,40H,6-7,10-13,16-17H2,1-2H3/t22-,23-,24-,28+,30-,31-,32-/m0/s1

IUPAC

[2-[(8S,9S,10R,11S,13S,14S,17R)-11,17-dihydroxy-10,13-dimethyl-3-oxo-2,6,7,8,9,11,12,14,15,16-decahydro-1H-cyclopenta[a]phenanthren-17-yl]-2-oxoethyl] 3-(2,5-dioxopyrrol-1-yl)benzoate

Product Data

Storage Temperature

+4°C

Shipping Temperature

Room Temperature

Country of Origin

CANADA

Product Format

Neat

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