Vitas-M small molecule compound

N,O-bis(tert-butoxycarbonyl)tyrosyl-L-alanylglycylhistidylprolinamide

Catalog ID
STL565354
SMILES O=C(NC(C(=O)N1CCCC1C(=O)N)Cc1c[nH]cn1)CNC(=O)[C@@H](NC(=O)C(Cc1ccc(cc1)OC(=O)OC(C)(C)C)NC(=O)OC(C)(C)C)C

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We supply compounds in quantities from 1 mg up to 5 g for research and development purposes only.

We do not supply quantities above 5 g.

Structure and other identifiers

2D representation rendered from the SMILES, with core physicochemical data.
Formula C35H50N8O10 MW 742.83 g/mol Purity >90% as per NMR
InChI
InChI=1S/C35H50N8O10/c1-20(29(46)38-18-27(44)41-25(16-22-17-37-19-39-22)31(48)43-14-8-9-26(43)28(36)45)40-30(47)24(42-32(49)52-34(2,3)4)15-21-10-12-23(13-11-21)51-33(50)53-35(5,6)7/h10-13,17,19-20,24-26H,8-9,14-16,18H2,1-7H3,(H2,36,45)(H,37,39)(H,38,46)(H
InChIKey
ICRZPMUCIXEABQ-XEWUMVRVSA-N
Synonyms

16395222
InChI=1SC35H50N8O10c120(29(46)381827(44)4125(16221737193922)31(48)43148926(43)28(36)45)4030(47)24(4232(49)5234(23)4)1521101223(131121)5133(50)5335(56)7h10131719202426H89141618H217H3(H23645)(H3739)(H3846)(H4047)(H4144)(H4249)t2024?25?26?m0s1
MFCD32651641
NObis(tertbutoxycarbonyl)tyrosylLalanylglycylhistidylprolinamide
O=C(NC(C(=O)N1CCCC1C(=O)N)Cc1c(nH)cn1)CNC(=O)(C@@H)(NC(=O)C(Cc1ccc(cc1)OC(=O)OC(C)(C)C)NC(=O)OC(C)(C)C)C
tertbutyl(3(4((tertbutoxycarbonyl)oxy)phenyl)1(((2S)1((2((1(2carbamoylpyrrolidin1yl)3(1Himidazol4yl)1oxopropan2yl)amino)2oxoethyl)amino)1oxopropan2yl)amino)1oxopropan2yl)carbamate
tertbutyl(4(3(((2S)1((2((1(2carbamoylpyrrolidin1yl)3(1Himidazol5yl)1oxopropan2yl)amino)2oxoethyl)amino)1oxopropan2yl)amino)2((2methylpropan2yl)oxycarbonylamino)3oxopropyl)phenyl)carbonate
ZINC000229904681
ZINC000253387746

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Available files

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