Atosiban acetate, min. 95 %, 50 mg

cas: 914453-95-5 — see every product listed under this CAS number, including other names

Atosiban acetate, min. 95 %, 50 mg (CAS 914453-95-5) is a chemical reagent available from Chemat. Available pack sizes: 50mg. Offered by: Roth.

brandRoth
catalog numberROTH-2CXP.3
cas914453-95-5
size50mg

Available pack sizes

brand size price
Roth 50mg 1722.66 Pln

properties

delivery time2 week
Structural formula: {0} (CAS {1})

Acetic acid;(2S)-N-[(2S)-5-amino-1-[(2-amino-2-oxoethyl)amino]-1-oxopentan-2-yl]-1-[(4R,7S,10S,13S,16R)-7-(2-amino-2-oxoethyl)-13-[(2S)-butan-2-yl]-16-[(4-ethoxyphenyl)methyl]-10-[(1R)-1-hydroxyethyl]-6,9,12,15,18-pentaoxo-1,2-dithia-5,8,11,14,17-pentazacycloicosane-4-carbonyl]pyrrolidine-2-carboxamide (CAS 914453-95-5) is a chemical compound with the molecular formula C45H71N11O14S2 and a molecular weight of 1054.2 g/mol. IUPAC name: acetic acid;(2S)-N-[(2S)-5-amino-1-[(2-amino-2-oxoethyl)amino]-1-oxopentan-2-yl]-1-[(4R,7S,10S,13S,16R)-7-(2-amino-2-oxoethyl)-13-[(2S)-butan-2-yl]-16-[(4-ethoxyphenyl)methyl]-10-[(1R)-1-hydroxyethyl]-6,9,12,15,18-pentaoxo-1,2-dithia-5,8,11,14,17-pentazacycloicosane-4-carbonyl]pyrrolidine-2-carboxamide. InChIKey: SVDWBHHCPXTODI-QIWYXCRTSA-N.

Identity
Molecular formulaC45H71N11O14S2
Molecular weight1054.2 g/mol
IUPAC nameacetic acid;(2S)-N-[(2S)-5-amino-1-[(2-amino-2-oxoethyl)amino]-1-oxopentan-2-yl]-1-[(4R,7S,10S,13S,16R)-7-(2-amino-2-oxoethyl)-13-[(2S)-butan-2-yl]-16-[(4-ethoxyphenyl)methyl]-10-[(1R)-1-hydroxyethyl]-6,9,12,15,18-pentaoxo-1,2-dithia-5,8,11,14,17-pentazacycloicosane-4-carbonyl]pyrrolidine-2-carboxamide
InChIKeySVDWBHHCPXTODI-QIWYXCRTSA-N
SMILESCC[C@H](C)[C@H]1C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@@H](CSSCCC(=O)N[C@@H](C(=O)N1)CC2=CC=C(C=C2)OCC)C(=O)N3CCC[C@H]3C(=O)N[C@@H](CCCN)C(=O)NCC(=O)N)CC(=O)N)[C@@H](C)O.CC(=O)O

Computed by PubChem (NCBI)

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