Vitas-M small molecule compound
methyl {6-chloro-4-methyl-2-oxo-7-[(pentamethylbenzyl)oxy]-2H-chromen-3-yl}acetate
Catalog ID
STK716807
SMILES COC(=O)Cc1c(=O)oc2c(c1C)cc(c(c2)OCc1c(C)c(C)c(c(c1C)C)C)Cl
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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 C25H27ClO5 MW 442.94 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H27ClO5/c1-12-13(2)15(4)20(16(5)14(12)3)11-30-23-10-22-18(8-21(23)26)17(6)19(25(28)31-22)9-24(27)29-7/h8,10H,9,11H2,1-7H3InChIKey
FDAXHBWIPKRRNE-UHFFFAOYSA-NSynonyms
586999-00-0586999000
CC1=C(C(=C(C(=C1C)C)COC2=C(C=C3C(=C(C(=O)OC3=C2)CC(=O)OC)C)Cl)C)C
InChI=1SC25H27ClO5c11213(2)15(4)20(16(5)14(12)3)113023102218(821(23)26)17(6)19(25(28)3122)924(27)297h810H911H217H3
methyl(6chloro4methyl2oxo7((pentamethylbenzyl)oxy)2Hchromen3yl)acetate
methyl2(6chloro4methyl2oxo7((23456pentamethylbenzyl)oxy)2Hchromen3yl)acetate
methyl2(6chloro4methyl2oxo7((23456pentamethylphenyl)methoxy)chromen3yl)acetate
MFCD04031316
ZINC000002394304
ZINC02394304
ZINC2394304
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