Vitas-M small molecule compound
3-(4-chlorophenyl)-2-methyl-4-oxo-4H-chromen-7-yl N-(tert-butoxycarbonyl)isoleucinate
Catalog ID
STL298348
SMILES CCC(C(C(=O)Oc1ccc2c(c1)oc(c(c2=O)c1ccc(cc1)Cl)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 C27H30ClNO6 MW 499.99 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H30ClNO6/c1-7-15(2)23(29-26(32)35-27(4,5)6)25(31)34-19-12-13-20-21(14-19)33-16(3)22(24(20)30)17-8-10-18(28)11-9-17/h8-15,23H,7H2,1-6H3,(H,29,32)InChIKey
IRECBNPBDIDGQS-UHFFFAOYSA-NSynonyms
1396994-59-4(3(4CHLOROPHENYL)2METHYL4OXOCHROMEN7YL)3METHYL2((2METHYLPROPAN2YL)OXYCARBONYLAMINO)PENTANOATE
1396994594
3(4chlorophenyl)2methyl4oxo4Hchromen7yl2((tertbutoxycarbonyl)amino)3methylpentanoate
3(4chlorophenyl)2methyl4oxo4Hchromen7ylN(tertbutoxycarbonyl)isoleucinate
CCC(C)C(C(=O)OC1=CC2=C(C=C1)C(=O)C(=C(O2)C)C3=CC=C(C=C3)Cl)NC(=O)OC(C)(C)C
InChI=1SC27H30ClNO6c1715(2)23(2926(32)3527(45)6)25(31)341912132021(1419)3316(3)22(24(20)30)1781018(28)11917h81523H7H216H3(H2932)
MFCD01563824
ZINC000001805022
ZINC000008826498
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