Products 1134880-79-7
CAS 1134880-79-7 appears in our catalog under these names: ((ring-D5)Phe3)-Octreotide, ((ring–D₅)Phe³)–Octreotide, ((ring-D5)Phe3)-Octreotide acetate salt. Offered by: Creative Peptides, GLPBio, Biosynth. Available pack sizes: on request, 0,5mg, 1mg, 500ug, 250ug, 1000ug.
Acetic acid;(4R,7S,10S,13R,16S,19R)-10-(4-aminobutyl)-19-[[(2R)-2-amino-3-phenylpropanoyl]amino]-N-[(2R,3R)-1,3-dihydroxybutan-2-yl]-7-[(1R)-1-hydroxyethyl]-13-(1H-indol-3-ylmethyl)-6,9,12,15,18-pentaoxo-16-[(2,3,4,5,6-pentadeuteriophenyl)methyl]-1,2-dithia-5,8,11,14,17-pentazacycloicosane-4-carboxamide (CAS 1134880-79-7) is a chemical compound with the molecular formula C51H70N10O12S2 and a molecular weight of 1084.3 g/mol. IUPAC name: acetic acid;(4R,7S,10S,13R,16S,19R)-10-(4-aminobutyl)-19-[[(2R)-2-amino-3-phenylpropanoyl]amino]-N-[(2R,3R)-1,3-dihydroxybutan-2-yl]-7-[(1R)-1-hydroxyethyl]-13-(1H-indol-3-ylmethyl)-6,9,12,15,18-pentaoxo-16-[(2,3,4,5,6-pentadeuteriophenyl)methyl]-1,2-dithia-5,8,11,14,17-pentazacycloicosane-4-carboxamide. InChIKey: XQEJFZYLWPSJOV-RQANEZAXSA-N.
| Molecular formula | C51H70N10O12S2 |
|---|---|
| Molecular weight | 1084.3 g/mol |
| IUPAC name | acetic acid;(4R,7S,10S,13R,16S,19R)-10-(4-aminobutyl)-19-[[(2R)-2-amino-3-phenylpropanoyl]amino]-N-[(2R,3R)-1,3-dihydroxybutan-2-yl]-7-[(1R)-1-hydroxyethyl]-13-(1H-indol-3-ylmethyl)-6,9,12,15,18-pentaoxo-16-[(2,3,4,5,6-pentadeuteriophenyl)methyl]-1,2-dithia-5,8,11,14,17-pentazacycloicosane-4-carboxamide |
| InChIKey | XQEJFZYLWPSJOV-RQANEZAXSA-N |
| SMILES | [2H]C1=C(C(=C(C(=C1[2H])[2H])C[C@H]2C(=O)N[C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@@H](CSSC[C@@H](C(=O)N2)NC(=O)[C@@H](CC3=CC=CC=C3)N)C(=O)N[C@H](CO)[C@@H](C)O)[C@@H](C)O)CCCCN)CC4=CNC5=CC=CC=C54)[2H])[2H].CC(=O)O |
Computed by PubChem (NCBI)