Vitas-M small molecule compound
6-butyl-3-(2-methyl-1,3-thiazol-4-yl)-4-oxo-4H-chromen-7-yl N,O-bis(tert-butoxycarbonyl)-D-tyrosinate
Catalog ID
STL524976
SMILES CCCCc1cc2c(cc1OC(=O)[C@@H](Cc1ccc(cc1)OC(=O)OC(C)(C)C)NC(=O)OC(C)(C)C)occ(c2=O)c1csc(n1)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 C36H42N2O9S MW 678.80 g/mol Purity >90% as per NMR
InChI
InChI=1S/C36H42N2O9S/c1-9-10-11-23-17-25-30(43-19-26(31(25)39)28-20-48-21(2)37-28)18-29(23)45-32(40)27(38-33(41)46-35(3,4)5)16-22-12-14-24(15-13-22)44-34(42)47-36(6,7)8/h12-15,17-20,27H,9-11,16H2,1-8H3,(H,38,41)/t27-/m1/s1InChIKey
CRTNHVNAKCZZBH-HHHXNRCGSA-NSynonyms
310396-33-9(6butyl3(2methyl13thiazol4yl)4oxochromen7yl)(2~(R))2((2methylpropan2yl)oxycarbonylamino)3(4((2methylpropan2yl)oxycarbonyloxy)phenyl)propanoate
(R)6butyl3(2methylthiazol4yl)4oxo4Hchromen7yl2((tertbutoxycarbonyl)amino)3(4((tertbutoxycarbonyl)oxy)phenyl)propanoate
16395351
310396339
6butyl3(2methyl13thiazol4yl)4oxo4Hchromen7ylNObis(tertbutoxycarbonyl)Dtyrosinate
CCCCc1cc2c(cc1OC(=O)(C@@H)(Cc1ccc(cc1)OC(=O)OC(C)(C)C)NC(=O)OC(C)(C)C)occ(c2=O)c1csc(n1)C
InChI=1SC36H42N2O9Sc19101123172530(431926(31(25)39)28204821(2)3728)1829(23)4532(40)27(3833(41)4635(34)5)1622121424(151322)4434(42)4736(67)8h1215172027H91116H218H3(H3841)t27m1s1
MFCD01082036
ZINC000085866981
ZINC85866981
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