Products 10551-48-1
CAS 10551-48-1 appears in our catalog under these names: [CYS(AC)]1-OXYTOCIN, N–Acetyloxytocin, Oxytocin Impurity 8, Oxytocin Impurity 10, N-Acetyl Oxystin. Offered by: Sigma-Aldrich, GLPBio, Chemat Brand, TRC, Chemat. Available pack sizes: 10MG, 1mg, on request, 250mg, 25mg, 5mg, 50mg, 50 mg.
(2S)-1-[(4R,7S,10S,13S,16S,19R)-19-acetamido-7-(2-amino-2-oxoethyl)-10-(3-amino-3-oxopropyl)-13-[(2S)-butan-2-yl]-16-[(4-hydroxyphenyl)methyl]-6,9,12,15,18-pentaoxo-1,2-dithia-5,8,11,14,17-pentazacycloicosane-4-carbonyl]-N-[(2S)-1-[(2-amino-2-oxoethyl)amino]-4-methyl-1-oxopentan-2-yl]pyrrolidine-2-carboxamide (CAS 10551-48-1) is a chemical compound with the molecular formula C45H68N12O13S2 and a molecular weight of 1049.2 g/mol. IUPAC name: (2S)-1-[(4R,7S,10S,13S,16S,19R)-19-acetamido-7-(2-amino-2-oxoethyl)-10-(3-amino-3-oxopropyl)-13-[(2S)-butan-2-yl]-16-[(4-hydroxyphenyl)methyl]-6,9,12,15,18-pentaoxo-1,2-dithia-5,8,11,14,17-pentazacycloicosane-4-carbonyl]-N-[(2S)-1-[(2-amino-2-oxoethyl)amino]-4-methyl-1-oxopentan-2-yl]pyrrolidine-2-carboxamide. InChIKey: RROMYFJBCBPTNU-RANNHORISA-N.
| Molecular formula | C45H68N12O13S2 |
|---|---|
| Molecular weight | 1049.2 g/mol |
| IUPAC name | (2S)-1-[(4R,7S,10S,13S,16S,19R)-19-acetamido-7-(2-amino-2-oxoethyl)-10-(3-amino-3-oxopropyl)-13-[(2S)-butan-2-yl]-16-[(4-hydroxyphenyl)methyl]-6,9,12,15,18-pentaoxo-1,2-dithia-5,8,11,14,17-pentazacycloicosane-4-carbonyl]-N-[(2S)-1-[(2-amino-2-oxoethyl)amino]-4-methyl-1-oxopentan-2-yl]pyrrolidine-2-carboxamide |
| InChIKey | RROMYFJBCBPTNU-RANNHORISA-N |
| SMILES | CC[C@H](C)[C@H]1C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@@H](CSSC[C@@H](C(=O)N[C@H](C(=O)N1)CC2=CC=C(C=C2)O)NC(=O)C)C(=O)N3CCC[C@H]3C(=O)N[C@@H](CC(C)C)C(=O)NCC(=O)N)CC(=O)N)CCC(=O)N |
Computed by PubChem (NCBI)