Vitas-M small molecule compound
3-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-2-methyl-4-oxo-4H-chromene-5,7-diyl diacetate
Catalog ID
STK857162
SMILES CC(=O)Oc1cc(OC(=O)C)cc2c1c(=O)c(c(o2)C)c1ccc2c(c1)OCCCO2
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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 C23H20O8 MW 424.41 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H20O8/c1-12-21(15-5-6-17-18(9-15)28-8-4-7-27-17)23(26)22-19(29-12)10-16(30-13(2)24)11-20(22)31-14(3)25/h5-6,9-11H,4,7-8H2,1-3H3InChIKey
GHSXLOPXMYFIKR-UHFFFAOYSA-NSynonyms
(5ACETYLOXY3(34DIHYDRO2H15BENZODIOXEPIN7YL)2METHYL4OXOCHROMEN7YL)ACETATE
3(34dihydro2H15benzodioxepin7yl)2methyl4oxo4Hchromene57diyldiacetate
3(34dihydro2Hbenzo(b)(14)dioxepin7yl)2methyl4oxo4Hchromene57diyldiacetate
ACETICACID7ACETOXY3(34DIHYDRO2HBENZO(B)(14)DIOXEPIN7YL)2METHYL4OXO4HCHROMEN5YLESTER
CC1=C(C(=O)C2=C(C=C(C=C2O1)OC(=O)C)OC(=O)C)C3=CC4=C(C=C3)OCCCO4
InChI=1SC23H20O8c11221(15561718(915)288472717)23(26)2219(2912)1016(3013(2)24)1120(22)3114(3)25h56911H478H213H3
MFCD01235783
ZINC000000636532
ZINC00636532
ZINC636532
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