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[1-Methyl-5-bis(2’-hydroxyethyl)aminobenzimidazolyl-2]butanoic Acid Methyl Ester-d5

Product Code

TRC-M294187

CAS Number

1276499-54-7

Product Format

Neat

Molecular Formula

C23 H36 N6 O5 S

Molecular Weight

508.634

Product Categories

TRC, Stable isotopes

Unlabelled CAS Number

109882-31-7

Price and availability

48-hour USA dispatch time
If Exact Weight packaging is selected, a certificate will be delivered with the product, which will indicate the mass of the material dispensed into the vial with a precision of up to 3 decimal places. Exceptions apply.

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Product Information

Chemical Data

Analyte Name

[1-Methyl-5-bis(2’-hydroxyethyl)aminobenzimidazolyl-2]butanoic Acid Methyl Ester-d5

CAS Number

1276499-54-7

Molecular Formula

C23 H36 N6 O5 S

Molecular Weight

508.634

Accurate Mass

508.247

SMILES

C[C@@H]1CCN([C@@H](C1)C(=O)O)C(=O)C(CCCNC(=N)N)NS(=O)(=O)c2cccc3CC(C)CNc23

InChI

InChI=1S/C23H36N6O5S/c1-14-8-10-29(18(12-14)22(31)32)21(30)17(6-4-9-26-23(24)25)28-35(33,34)19-7-3-5-16-11-15(2)13-27-20(16)19/h3,5,7,14-15,17-18,27-28H,4,6,8-13H2,1-2H3,(H,31,32)(H4,24,25,26)/t14-,15?,17?,18+/m1/s1

IUPAC

(2S,4R)-1-[5-carbamimidamido-2-[(3-methyl-1,2,3,4-tetrahydroquinolin-8-yl)sulfonylamino]pentanoyl]-4-methylpiperidine-2-carboxylic acid

Unlabelled CAS Number

109882-31-7

SIL Type

Deuterium

Product Data

Shipping Temperature

Room Temperature

Country of Origin

CANADA

Product Format

Neat

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