Vitas-M small molecule compound

ethyl 3-{7-[(4-tert-butylbenzyl)oxy]-4-methyl-2-oxo-2H-chromen-3-yl}propanoate

Catalog ID
STL463215
SMILES CCOC(=O)CCc1c(=O)oc2c(c1C)ccc(c2)OCc1ccc(cc1)C(C)(C)C

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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 C26H30O5 MW 422.52 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H30O5/c1-6-29-24(27)14-13-22-17(2)21-12-11-20(15-23(21)31-25(22)28)30-16-18-7-9-19(10-8-18)26(3,4)5/h7-12,15H,6,13-14,16H2,1-5H3
InChIKey
OVXMLUFWROWUBE-UHFFFAOYSA-N
Synonyms
858761-25-8
858761258
CCOC(=O)CCC1=C(C2=C(C=C(C=C2)OCC3=CC=C(C=C3)C(C)(C)C)OC1=O)C
ethyl3(7((4(tertbutyl)benzyl)oxy)4methyl2oxo2Hchromen3yl)propanoate
ethyl3(7((4tertbutylbenzyl)oxy)4methyl2oxo2Hchromen3yl)propanoate
ETHYL3(7((4TERTBUTYLPHENYL)METHOXY)4METHYL2OXOCHROMEN3YL)PROPANOATE
InChI=1SC26H30O5c162924(27)14132217(2)21121120(1523(21)3125(22)28)3016187919(10818)26(34)5h71215H6131416H215H3
MFCD03854396
ZINC000002152135
ZINC02152135
ZINC2152135

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Available files

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