Vitas-M small molecule compound
3-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-2-methyl-4-oxo-4H-chromen-7-yl acetate
Catalog ID
STK976113
SMILES CC(=O)Oc1ccc2c(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 C21H18O6 MW 366.37 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H18O6/c1-12-20(14-4-7-17-19(10-14)25-9-3-8-24-17)21(23)16-6-5-15(27-13(2)22)11-18(16)26-12/h4-7,10-11H,3,8-9H2,1-2H3InChIKey
DFKYSPQGQUZWCR-UHFFFAOYSA-NSynonyms
170511-43-0(3(34DIHYDRO2H15BENZODIOXEPIN7YL)2METHYL4OXOCHROMEN7YL)ACETATE
170511430
3(2H3H4HBENZO(B)14DIOXEPAN7YL)2METHYL4OXOCHROMEN7YLACETATE
3(34DIHYDRO2H15BENZODIOXEPIN7YL)2METHYL4OXO4HCHROMEN7YLACETATE
3(34DIHYDRO2HBENZO(B)(14)DIOXEPIN7YL)2METHYL4OXO4HCHROMEN7YLACETATE
CC1=C(C(=O)C2=C(O1)C=C(C=C2)OC(=O)C)C3=CC4=C(C=C3)OCCCO4
InChI=1SC21H18O6c11220(14471719(1014)259382417)21(23)166515(2713(2)22)1118(16)2612h471011H389H212H3
MFCD00525164
ZINC000001082424
ZINC01082424
ZINC1082424
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