Vitas-M small molecule compound
3,4-dimethyl-2-oxo-2H-chromen-7-yl N-(tert-butoxycarbonyl)-D-isoleucinate
Catalog ID
STL540629
SMILES CC[C@@H]([C@H](C(=O)Oc1ccc2c(c1)oc(=O)c(c2C)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 C22H29NO6 MW 403.48 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H29NO6/c1-8-12(2)18(23-21(26)29-22(5,6)7)20(25)27-15-9-10-16-13(3)14(4)19(24)28-17(16)11-15/h9-12,18H,8H2,1-7H3,(H,23,26)/t12-,18+/m0/s1InChIKey
PJVNDTSZOIYHLM-KPZWWZAWSA-NSynonyms
(2S3R)34dimethyl2oxo2Hchromen7yl2((tertbutoxycarbonyl)amino)3methylpentanoate
(34dimethyl2oxochromen7yl)(2~(R)3~(S))3methyl2((2methylpropan2yl)oxycarbonylamino)pentanoate
124361454
34dimethyl2oxo2Hchromen7ylN(tertbutoxycarbonyl)Disoleucinate
CC(C@H)((C@@H)(C(=O)Oc1ccc2c(c1)oc(=O)c(c2C)C)NC(=O)OC(C)(C)C)C
InChI=1SC22H29NO6c1812(2)18(2321(26)2922(56)7)20(25)27159101613(3)14(4)19(24)2817(16)1115h91218H8H217H3(H2326)t1218+m0s1
ZINC000016031291
ZINC16031291
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