Vitas-M small molecule compound

methyl {4,8-dimethyl-7-[(2-methylbenzyl)oxy]-2-oxo-2H-chromen-3-yl}acetate

Catalog ID
STL460382
SMILES COC(=O)Cc1c(=O)oc2c(c1C)ccc(c2C)OCc1ccccc1C

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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 C22H22O5 MW 366.41 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H22O5/c1-13-7-5-6-8-16(13)12-26-19-10-9-17-14(2)18(11-20(23)25-4)22(24)27-21(17)15(19)3/h5-10H,11-12H2,1-4H3
InChIKey
FWQKULXUCWEHCW-UHFFFAOYSA-N
Synonyms
858752-18-8
858752188
CC1=CC=CC=C1COC2=C(C3=C(C=C2)C(=C(C(=O)O3)CC(=O)OC)C)C
InChI=1SC22H22O5c113756816(13)1226191091714(2)18(1120(23)254)22(24)2721(17)15(19)3h510H1112H214H3
methyl(48dimethyl7((2methylbenzyl)oxy)2oxo2Hchromen3yl)acetate
methyl2(48dimethyl7((2methylbenzyl)oxy)2oxo2Hchromen3yl)acetate
METHYL2(48DIMETHYL7((2METHYLPHENYL)METHOXY)2OXOCHROMEN3YL)ACETATE
MFCD03851204
ZINC000002148558
ZINC02148558
ZINC2148558

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.