Vitas-M small molecule compound

(2Z)-2-[(2-methyl-2H-chromen-3-yl)methylidene]-3-oxo-2,3-dihydro-1-benzofuran-6-yl 3,5-dimethoxybenzoate

Catalog ID
STL033001
SMILES COc1cc(OC)cc(c1)C(=O)Oc1ccc2c(c1)O/C(=C\C1=Cc3ccccc3OC1C)/C2=O

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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 C28H22O7 MW 470.48 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H22O7/c1-16-18(10-17-6-4-5-7-24(17)33-16)13-26-27(29)23-9-8-20(15-25(23)35-26)34-28(30)19-11-21(31-2)14-22(12-19)32-3/h4-16H,1-3H3/b26-13-
InChIKey
WEZVXOOBHREKHT-ZMFRSBBQSA-N
Synonyms
859666-80-1
((2Z)2((2methyl2Hchromen3yl)methylidene)3oxo1benzofuran6yl)35dimethoxybenzoate
(2Z)2((2methyl2Hchromen3yl)methylidene)3oxo23dihydro1benzofuran6yl35dimethoxybenzoate
(Z)2((2methyl2Hchromen3yl)methylene)3oxo23dihydrobenzofuran6yl35dimethoxybenzoate
2((2METHYL(2HCHROMEN3YL))METHYLENE)3OXOBENZO(34B)FURAN6YL35DIMETHOXYBENZOATE
859666801
CC1C(=CC2=CC=CC=C2O1)C=C3C(=O)C4=C(O3)C=C(C=C4)OC(=O)C5=CC(=CC(=C5)OC)OC
COc1cc(OC)cc(c1)C(=O)Oc1ccc2c(c1)OC(=CC1=Cc3ccccc3OC1C)C2=O
InChI=1SC28H22O7c11618(1017645724(17)3316)132627(29)239820(1525(23)3526)3428(30)191121(312)1422(1219)323h416H13H3b2613
MFCD06495323
ZINC000002135750
ZINC000002135757

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Available files

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