Products 914453-98-8
CAS 914453-98-8 appears in our catalog under these names: Ornipressin (acetate), ≥98%, ≥98%, Ornipressin acetate, 95%, Ornipressin Acetate（3397-23-7，free）/ 100%, Ornipressin (acetate), Ornipressin acetate. Offered by: Chemat, Combi-blocks, TargetMol, GLPBio, Biosynth. Available pack sizes: 5mg, 10mg, 25mg, 50mg, 100mg, 1g, 250mg, 2mg.
Acetic acid;(2S)-N-[(2S)-5-amino-1-[(2-amino-2-oxoethyl)amino]-1-oxopentan-2-yl]-1-[(4R,7S,10S,13S,16S,19R)-19-amino-7-(2-amino-2-oxoethyl)-10-(3-amino-3-oxopropyl)-13-benzyl-16-[(4-hydroxyphenyl)methyl]-6,9,12,15,18-pentaoxo-1,2-dithia-5,8,11,14,17-pentazacycloicosane-4-carbonyl]pyrrolidine-2-carboxamide (CAS 914453-98-8) is a chemical compound with the molecular formula C47H67N13O14S2 and a molecular weight of 1102.2 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,16S,19R)-19-amino-7-(2-amino-2-oxoethyl)-10-(3-amino-3-oxopropyl)-13-benzyl-16-[(4-hydroxyphenyl)methyl]-6,9,12,15,18-pentaoxo-1,2-dithia-5,8,11,14,17-pentazacycloicosane-4-carbonyl]pyrrolidine-2-carboxamide. InChIKey: AYJSELDHDXYDKX-HPILINOVSA-N.
| Molecular formula | C47H67N13O14S2 |
|---|---|
| Molecular weight | 1102.2 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,16S,19R)-19-amino-7-(2-amino-2-oxoethyl)-10-(3-amino-3-oxopropyl)-13-benzyl-16-[(4-hydroxyphenyl)methyl]-6,9,12,15,18-pentaoxo-1,2-dithia-5,8,11,14,17-pentazacycloicosane-4-carbonyl]pyrrolidine-2-carboxamide |
| InChIKey | AYJSELDHDXYDKX-HPILINOVSA-N |
| SMILES | CC(=O)O.C1C[C@H](N(C1)C(=O)[C@@H]2CSSC[C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N2)CC(=O)N)CCC(=O)N)CC3=CC=CC=C3)CC4=CC=C(C=C4)O)N)C(=O)N[C@@H](CCCN)C(=O)NCC(=O)N |
Computed by PubChem (NCBI)