Vitas-M small molecule compound

tert-butoxycarbonyl glycylleucyl-L-prolyl-L-cysteinyl-L-asparaginate

Catalog ID
STL565388
SMILES NCC(=O)NC(C(=O)N1CCC[C@H]1C(=O)N[C@H](C(=O)N[C@@H](C(=O)OC(=O)OC(C)(C)C)CC(=O)N)CS)CC(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 C25H42N6O9S MW 602.71 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H42N6O9S/c1-13(2)9-14(28-19(33)11-26)22(36)31-8-6-7-17(31)21(35)30-16(12-41)20(34)29-15(10-18(27)32)23(37)39-24(38)40-25(3,4)5/h13-17,41H,6-12,26H2,1-5H3,(H2,27,32)(H,28,33)(H,29,34)(H,30,35)/t14?,15-,16-,17-/m0/s1
InChIKey
UTGUKTQOTCXQJK-OZCCTXIFSA-N
Synonyms

(2methylpropan2yl)oxycarbonyl(2S)4amino2(((2R)2(((2S)1(2((2aminoacetyl)amino)4methylpentanoyl)pyrrolidine2carbonyl)amino)3sulfanylpropanoyl)amino)4oxobutanoate
(2S)4amino2((2R)2((2S)1(2(2aminoacetamido)4methylpentanoyl)pyrrolidine2carboxamido)3mercaptopropanamido)4oxobutanoic(tertbutylcarbonic)anhydride
131664701
InChI=1SC25H42N6O9Sc113(2)914(2819(33)1126)22(36)3186717(31)21(35)3016(1241)20(34)2915(1018(27)32)23(37)3924(38)4025(34)5h131741H61226H215H3(H22732)(H2833)(H2934)(H3035)t14?151617m0s1
MFCD32651652
NCC(=O)NC(C(=O)N1CCC(C@H)1C(=O)N(C@H)(C(=O)N(C@H)(C(=O)OC(=O)OC(C)(C)C)CC(=O)N)CS)CC(C)C
tertbutoxycarbonylglycylleucylLprolylLcysteinylLasparaginate
ZINC000070669892
ZINC000072330326

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.