Vitas-M small molecule compound
3-benzyl-4,8-dimethyl-2-oxo-2H-chromen-7-yl 2-[(tert-butoxycarbonyl)amino]butanoate
Catalog ID
STL462359
SMILES CCC(C(=O)Oc1ccc2c(c1C)oc(=O)c(c2C)Cc1ccccc1)NC(=O)OC(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 C27H31NO6 MW 465.55 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H31NO6/c1-7-21(28-26(31)34-27(4,5)6)25(30)32-22-14-13-19-16(2)20(15-18-11-9-8-10-12-18)24(29)33-23(19)17(22)3/h8-14,21H,7,15H2,1-6H3,(H,28,31)InChIKey
WVMWXKYKUXNMRV-UHFFFAOYSA-NSynonyms
1024593-72-3(3BENZYL48DIMETHYL2OXOCHROMEN7YL)2((2METHYLPROPAN2YL)OXYCARBONYLAMINO)BUTANOATE
1024593723
3benzyl48dimethyl2oxo2Hchromen7yl2((tertbutoxycarbonyl)amino)butanoate
CCC(C(=O)OC1=C(C2=C(C=C1)C(=C(C(=O)O2)CC3=CC=CC=C3)C)C)NC(=O)OC(C)(C)C
InChI=1SC27H31NO6c1721(2826(31)3427(45)6)25(30)322214131916(2)20(15181198101218)24(29)3323(19)17(22)3h81421H715H216H3(H2831)
MFCD03850382
ZINC000002091912
ZINC000002091914
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