A216620
N-Acetyl Oxystin
| Trivial name | N-Acetyl Oxystin |
| Catalog Number | TRC-A216620-250MG |
| Alternative Name(s) | N-Acetyloxytocin; 1-(N-acetylcysteine) Oxytocin; 1,2-Dithia-5,8,11,14,17-pentaazacycloeicosane Cyclic Peptide Derivative; (2S)-1-((4R,7S,10S,16S,19R)-19-Acetamido-7-(2-amino-2-oxoethyl)-10-(3-amino-3-oxopropyl)-13-((S)-sec-butyl)-16-(4-hydroxybenzyl)-6,9,12,15,18-pentaoxo-1,2-dithia-5,8,11,14,17-pentaazacycloicosane-4-carbonyl)-N-((S)-1-((2-amino-2-oxoethyl)amino)-4-methyl-1-oxopentan-2-yl)pyrrolidine-2-carboxamide |
| Molecular Formula | C₄₅H₆₈N₁₂O₁₃S₂ |
| CAS# | 10551-48-1 |
| Inchi | InChI=1S/C45H68N12O13S2/c1-6-23(4)37-44(69)51-27(13-14-34(46)60)39(64)53-30(18-35(47)61)40(65)55-32(45(70)57-15-7-8-33(57)43(68)54-28(16-22(2)3)38(63)49-19-36(48)62)21-72-71-20-31(50-24(5)58)42(67)52-29(41(66)56-37)17-25-9-11-26(59)12-10-25/h9-12,22-23,27 |
| SMILES | O=C(NC([C@H](CC)C)C(N[C@@H](CCC(N)=O)C(N[C@H]1CC(N)=O)=O)=O)[C@H](CC2=CC=C(O)C=C2)NC([C@@H](NC(C)=O)CSSC[C@@H](C(N3CCC[C@H]3C(N[C@@H](CC(C)C)C(NCC(N)=O)=O)=O)=O)NC1=O)=O |
| Beilstein Registry Number | NA |
| Size | 250mg |
| Supplier Page | https://www.lgcstandards.com/CA/en/p/TRC-A216620-250MG |