Vitas-M small molecule compound
3-(2,3-dihydro-1,4-benzodioxin-6-yl)-4-oxo-6-propyl-4H-chromen-7-yl methanesulfonate
Catalog ID
STK844670
SMILES CCCc1cc2c(cc1OS(=O)(=O)C)occ(c2=O)c1ccc2c(c1)OCCO2
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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 C21H20O7S MW 416.45 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H20O7S/c1-3-4-14-9-15-19(11-18(14)28-29(2,23)24)27-12-16(21(15)22)13-5-6-17-20(10-13)26-8-7-25-17/h5-6,9-12H,3-4,7-8H2,1-2H3InChIKey
DRTNEMOLKLVAML-UHFFFAOYSA-NSynonyms
610760-41-3(3(23DIHYDRO14BENZODIOXIN6YL)4OXO6PROPYLCHROMEN7YL)METHANESULFONATE
3(23dihydro14benzodioxin6yl)4oxo6propyl4Hchromen7ylmethanesulfonate
3(23DIHYDROBENZO(B)(14)DIOXIN6YL)4OXO6PROPYL4HCHROMEN7YLMETHANESULFONATE
3(2H3HBENZO(34E)14DIOXAN6YL)4OXO6PROPYLCHROMEN7YLMETHYLSULFONATE
610760413
CCCC1=C(C=C2C(=C1)C(=O)C(=CO2)C3=CC4=C(C=C3)OCCO4)OS(=O)(=O)C
InChI=1SC21H20O7Sc1341491519(1118(14)2829(223)24)271216(21(15)22)13561720(1013)26872517h56912H3478H212H3
MFCD03671386
ZINC000002203844
ZINC02203844
ZINC2203844
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