Vitas-M small molecule compound
3-[4-(ethoxycarbonyl)phenoxy]-2-methyl-4-oxo-4H-chromen-7-yl 1,3-benzodioxole-5-carboxylate
Catalog ID
STL033994
SMILES CCOC(=O)c1ccc(cc1)Oc1c(C)oc2c(c1=O)ccc(c2)OC(=O)c1ccc2c(c1)OCO2
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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 C27H20O9 MW 488.45 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H20O9/c1-3-31-26(29)16-4-7-18(8-5-16)35-25-15(2)34-22-13-19(9-10-20(22)24(25)28)36-27(30)17-6-11-21-23(12-17)33-14-32-21/h4-13H,3,14H2,1-2H3InChIKey
HQLHDDDWHYTMFV-UHFFFAOYSA-NSynonyms
858768-28-2(3(4ETHOXYCARBONYLPHENOXY)2METHYL4OXOCHROMEN7YL)13BENZODIOXOLE5CARBOXYLATE
3(4(ethoxycarbonyl)phenoxy)2methyl4oxo4Hchromen7yl13benzodioxole5carboxylate
3(4(ETHOXYCARBONYL)PHENOXY)2METHYL4OXO4HCHROMEN7YLBENZO(D)(13)DIOXOLE5CARBOXYLATE
3(4(ETHOXYCARBONYL)PHENOXY)2METHYL4OXOCHROMEN7YL2HBENZO(34D)13DIOXOLANE5CARBOXYLATE
858768282
CCOC(=O)C1=CC=C(C=C1)OC2=C(OC3=C(C2=O)C=CC(=C3)OC(=O)C4=CC5=C(C=C4)OCO5)C
InChI=1SC27H20O9c133126(29)164718(8516)352515(2)34221319(91020(22)24(25)28)3627(30)176112123(1217)33143221h413H314H212H3
MFCD04145348
ZINC000002157594
ZINC02157594
ZINC2157594
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