Vitas-M small molecule compound
3-(2,3-dihydro-1,4-benzodioxin-6-yl)-4-oxo-6-propyl-4H-chromen-7-yl 4-chlorobenzoate
Catalog ID
STK556193
SMILES CCCc1cc2c(cc1OC(=O)c1ccc(cc1)Cl)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 C27H21ClO6 MW 476.91 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H21ClO6/c1-2-3-18-12-20-24(14-23(18)34-27(30)16-4-7-19(28)8-5-16)33-15-21(26(20)29)17-6-9-22-25(13-17)32-11-10-31-22/h4-9,12-15H,2-3,10-11H2,1H3InChIKey
CAAFKGDXUKJEHX-UHFFFAOYSA-NSynonyms
610760-38-8(3(23DIHYDRO14BENZODIOXIN6YL)4OXO6PROPYLCHROMEN7YL)4CHLOROBENZOATE
3(23dihydro14benzodioxin6yl)4oxo6propyl4Hchromen7yl4chlorobenzoate
3(23dihydrobenzo(b)(14)dioxin6yl)4oxo6propyl4Hchromen7yl4chlorobenzoate
3(2H3HBENZO(34E)14DIOXAN6YL)4OXO6PROPYLCHROMEN7YL4CHLOROBENZOATE
610760388
CCCC1=C(C=C2C(=C1)C(=O)C(=CO2)C3=CC4=C(C=C3)OCCO4)OC(=O)C5=CC=C(C=C5)Cl
InChI=1SC27H21ClO6c12318122024(1423(18)3427(30)164719(28)8516)331521(26(20)29)17692225(1317)3211103122h491215H231011H21H3
MFCD04016312
ZINC000002667497
ZINC02667497
ZINC2667497
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