Vitas-M small molecule compound
6-ethyl-3-(4-nitrophenoxy)-4-oxo-2-(trifluoromethyl)-4H-chromen-7-yl N-(tert-butoxycarbonyl)-L-leucinate
Catalog ID
STK717859
SMILES CCc1cc2c(cc1OC(=O)[C@@H](NC(=O)OC(C)(C)C)CC(C)C)oc(c(c2=O)Oc1ccc(cc1)[N+](=O)[O-])C(F)(F)F
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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 C29H31F3N2O9 MW 608.57 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H31F3N2O9/c1-7-16-13-19-22(14-21(16)42-26(36)20(12-15(2)3)33-27(37)43-28(4,5)6)41-25(29(30,31)32)24(23(19)35)40-18-10-8-17(9-11-18)34(38)39/h8-11,13-15,20H,7,12H2,1-6H3,(H,33,37)/t20-/m0/s1InChIKey
OJYJXYOQSWKPPO-FQEVSTJZSA-NSynonyms
(6ethyl3(4nitrophenoxy)4oxo2(trifluoromethyl)chromen7yl)(2S)4methyl2((2methylpropan2yl)oxycarbonylamino)pentanoate
6ethyl3(4nitrophenoxy)4oxo2(trifluoromethyl)4Hchromen7yl2((tertbutoxycarbonyl)amino)4methylpentanoate
6ethyl3(4nitrophenoxy)4oxo2(trifluoromethyl)4Hchromen7ylN(tertbutoxycarbonyl)Lleucinate
CCC1=C(C=C2C(=C1)C(=O)C(=C(O2)C(F)(F)F)OC3=CC=C(C=C3)(N+)(=O)(O))OC(=O)C(CC(C)C)NC(=O)OC(C)(C)C
CCc1cc2c(cc1OC(=O)(C@@H)(NC(=O)OC(C)(C)C)CC(C)C)oc(c(c2=O)Oc1ccc(cc1)(N+)(=O)(O))C(F)(F)F
CCc1cc2c(cc1OC(=O)C(NC(=O)OC(C)(C)C)CC(C)C)oc(c(c2=O)Oc1ccc(cc1)(N+)(=O)(O))C(F)(F)F
InChI=1SC29H31F3N2O9c1716131922(1421(16)4226(36)20(1215(2)3)3327(37)4328(45)6)4125(29(3031)32)24(23(19)35)401810817(91118)34(38)39h811131520H712H216H3(H3337)t20m0s1
MFCD13371594
ZINC000102674876
ZINC102674876
Check stock
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Check stock on Vitas-MAvailable files
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