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Product Overview

Product Code

TRC-L330585

Product Format

Neat

Molecular Formula

C34 H57 N9 O6 . x(C2 H F3 O2)

Molecular Weight

801.9

API Family

Leuprolide

Product Categories

TRC, Impurity Reference Materials , Additional Neuro Products

Product Type

Metabolite

Alternate CAS Number

129244-90-2

Documentation

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Product Information

Chemical Data

Analyte Name

5-9-Leuprolide xTFA Salt

Molecular Formula

C34 H57 N9 O6 . x(C2 H F3 O2)

Molecular Weight

801.9

SMILES

CCNC(=O)[C@@H]1CCCN1C(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](CC(C)C)NC(=O)[C@@H](N)Cc2ccc(O)cc2.OC(=O)C(F)(F)F

InChI

InChI=1S/C34H57N9O6.C2HF3O2/c1-6-38-32(48)28-10-8-16-43(28)33(49)25(9-7-15-39-34(36)37)40-30(46)27(18-21(4)5)42-31(47)26(17-20(2)3)41-29(45)24(35)19-22-11-13-23(44)14-12-22;3-2(4,5)1(6)7/h11-14,20-21,24-28,44H,6-10,15-19,35H2,1-5H3,(H,38,48)(H,40,46)(H,41,45)(H,42,47)(H4,36,37,39);(H,6,7)/t24-,25-,26+,27-,28-;/m0./s1

IUPAC

(2S)-1-[(2S)-2-[[(2S)-2-[[(2R)-2-[[(2S)-2-amino-3-(4-hydroxyphenyl)propanoyl]amino]-4-methyl-pentanoyl]amino]-4-methyl-pentanoyl]amino]-5-guanidino-pentanoyl]-N-ethyl-pyrrolidine-2-carboxamide;2,2,2-trifluoroacetic acid

Alternate CAS Number

129244-90-2

Product Data

Storage Temperature

-20°C

Shipping Temperature

Room Temperature

Country of Origin

CANADA

Product Type

Metabolite

Product Format

Neat

API Family

Leuprolide

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