Vitas-M small molecule compound
methyl {[3-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-2-methyl-4-oxo-4H-chromen-7-yl]oxy}acetate
Catalog ID
STK049538
SMILES COC(=O)COc1ccc2c(c1)oc(c(c2=O)c1ccc2c(c1)OCCCO2)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 C22H20O7 MW 396.40 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H20O7/c1-13-21(14-4-7-17-19(10-14)27-9-3-8-26-17)22(24)16-6-5-15(11-18(16)29-13)28-12-20(23)25-2/h4-7,10-11H,3,8-9,12H2,1-2H3InChIKey
UOFGIACUSOQJNN-UHFFFAOYSA-NSynonyms
227094-56-6227094566
CC1=C(C(=O)C2=C(O1)C=C(C=C2)OCC(=O)OC)C3=CC4=C(C=C3)OCCCO4
COC(=O)COc1ccc2c(c1)oc(c(c2=O)c1ccc2c(c1)OCCCO2)C
InChI=1SC22H20O7c11321(14471719(1014)279382617)22(24)166515(1118(16)2913)281220(23)252h471011H38912H212H3
METHYL((3(34DIHYDRO2H15BENZODIOXEPIN7YL)2METHYL4OXO4HCHROMEN7YL)OXY)ACETATE
methyl2((3(34dihydro2Hbenzo(b)(14)dioxepin7yl)2methyl4oxo4Hchromen7yl)oxy)acetate
METHYL2(3(2H3H4HBENZO(B)14DIOXEPIN7YL)2METHYL4OXOCHROMEN7YLOXY)ACETATE
METHYL2(3(34DIHYDRO2H15BENZODIOXEPIN7YL)2METHYL4OXOCHROMEN7YL)OXYACETATE
MFCD00991574
STK049538
ZINC000000829486
ZINC00829486
ZINC829486
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