Vitas-M small molecule compound
2-methyl-3-(4-nitrophenyl)-4-oxo-4H-chromen-7-yl N-(tert-butoxycarbonyl)valinate
Catalog ID
STL298400
SMILES O=C(OC(C)(C)C)NC(C(=O)Oc1ccc2c(c1)oc(c(c2=O)c1ccc(cc1)[N+](=O)[O-])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 C26H28N2O8 MW 496.52 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H28N2O8/c1-14(2)22(27-25(31)36-26(4,5)6)24(30)35-18-11-12-19-20(13-18)34-15(3)21(23(19)29)16-7-9-17(10-8-16)28(32)33/h7-14,22H,1-6H3,(H,27,31)InChIKey
GQZKGYOUCNWEFN-UHFFFAOYSA-NSynonyms
1396969-36-0(2METHYL3(4NITROPHENYL)4OXOCHROMEN7YL)3METHYL2((2METHYLPROPAN2YL)OXYCARBONYLAMINO)BUTANOATE
1396969360
2methyl3(4nitrophenyl)4oxo4Hchromen7yl2((tertbutoxycarbonyl)amino)3methylbutanoate
2methyl3(4nitrophenyl)4oxo4Hchromen7ylN(tertbutoxycarbonyl)valinate
2TERTBUTOXYCARBONYLAMINO3METHYLBUTYRICACID2METHYL3(4NITROPHENYL)4OXO4HCHROMEN7YLESTER
CC1=C(C(=O)C2=C(O1)C=C(C=C2)OC(=O)C(C(C)C)NC(=O)OC(C)(C)C)C3=CC=C(C=C3)(N+)(=O)(O)
InChI=1SC26H28N2O8c114(2)22(2725(31)3626(45)6)24(30)351811121920(1318)3415(3)21(23(19)29)167917(10816)28(32)33h71422H16H3(H2731)
MFCD01561411
O=C(OC(C)(C)C)NC(C(=O)Oc1ccc2c(c1)oc(c(c2=O)c1ccc(cc1)(N+)(=O)(O))C)C(C)C
ZINC000008691495
ZINC000008809473
Check stock
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Check stock on Vitas-MAvailable files
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