Vitas-M small molecule compound

4-butyl-8-methyl-2-oxo-2H-chromen-7-yl N-(tert-butoxycarbonyl)-D-alaninate

Catalog ID
STL530099
SMILES CCCCc1cc(=O)oc2c1ccc(c2C)OC(=O)[C@H](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 C22H29NO6 MW 403.48 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H29NO6/c1-7-8-9-15-12-18(24)28-19-13(2)17(11-10-16(15)19)27-20(25)14(3)23-21(26)29-22(4,5)6/h10-12,14H,7-9H2,1-6H3,(H,23,26)/t14-/m1/s1
InChIKey
XWUUTLHPBBYAOK-CQSZACIVSA-N
Synonyms

(4butyl8methyl2oxochromen7yl)(2~(R))2((2methylpropan2yl)oxycarbonylamino)propanoate
(S)4butyl8methyl2oxo2Hchromen7yl2((tertbutoxycarbonyl)amino)propanoate
4butyl8methyl2oxo2Hchromen7ylN(tertbutoxycarbonyl)Dalaninate
6568578
CCCCc1cc(=O)oc2c1ccc(c2C)OC(=O)(C@@H)(NC(=O)OC(C)(C)C)C
InChI=1SC22H29NO6c1789151218(24)281913(2)17(111016(15)19)2720(25)14(3)2321(26)2922(45)6h101214H79H216H3(H2326)t14m1s1
ZINC000016042786
ZINC16042786

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Available files

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