Melagatran, >95% (HPLC)

cas: 159776-70-2 — see every product listed under this CAS number, including other names

Melagatran, >95% (HPLC) (CAS 159776-70-2) is a chemical reagent available from Chemat. Available pack sizes: 10mg, 1mg, 5mg. Offered by: TRC.

brandTRC
catalog numberTRC-M208450-10MG
cas159776-70-2
size10mg
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Available pack sizes

brand size price
TRC 10mg price on request
TRC 1mg price on request
TRC 5mg price on request

properties

purity>95% (HPLC)
delivery timeTo be confirmed by Chemat
Structural formula: {0} (CAS {1})

Melagatran is a member of the class of azetidines that is (2S)-azetidine 2-carboxylic acid in which the carboxylic acid has been converted to the amide corresponding to formal condensation with 4-(aminomethyl)benzenecarboximidamide and in which the hydrogen attached to the azetidine nitrogen is replaced by a (2R)-2-cyclohexyl-2-[(carboxymethyl)amino]acetyl group. It has a role as an anticoagulant, a serine protease inhibitor and an EC 3.4.21.5 (thrombin) inhibitor. It is a carboxamidine, a dicarboxylic acid monoamide, a member of azetidines, a secondary amino compound and a non-proteinogenic alpha-amino acid.

Source: ChEBI

Identity
Molecular formulaC22H31N5O4
Molecular weight429.5 g/mol
IUPAC name2-[[(1R)-2-[(2S)-2-[(4-carbamimidoylphenyl)methylcarbamoyl]azetidin-1-yl]-1-cyclohexyl-2-oxoethyl]amino]acetic acid
InChIKeyDKWNMCUOEDMMIN-PKOBYXMFSA-N
SMILESC1CCC(CC1)[C@H](C(=O)N2CC[C@H]2C(=O)NCC3=CC=C(C=C3)C(=N)N)NCC(=O)O

Computed by PubChem (NCBI)

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