Vitas-M small molecule compound

(2Z)-2-(2H-chromen-3-ylmethylidene)-3-oxo-2,3-dihydro-1-benzofuran-6-yl 2,6-dimethoxybenzoate

Catalog ID
STL032997
SMILES COc1cccc(c1C(=O)Oc1ccc2c(c1)O/C(=C\C1=Cc3c(OC1)cccc3)/C2=O)OC

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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 C27H20O7 MW 456.45 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H20O7/c1-30-21-8-5-9-22(31-2)25(21)27(29)33-18-10-11-19-23(14-18)34-24(26(19)28)13-16-12-17-6-3-4-7-20(17)32-15-16/h3-14H,15H2,1-2H3/b24-13-
InChIKey
GSWZWXTTZSUZIV-CFRMEGHHSA-N
Synonyms
859663-02-8
((2Z)2(2HCHROMEN3YLMETHYLIDENE)3OXO1BENZOFURAN6YL)26DIMETHOXYBENZOATE
(2Z)2(2Hchromen3ylmethylidene)3oxo23dihydro1benzofuran6yl26dimethoxybenzoate
(Z)2((2Hchromen3yl)methylene)3oxo23dihydrobenzofuran6yl26dimethoxybenzoate
2(2HCHROMEN3YLMETHYLENE)3OXOBENZO(34B)FURAN6YL26DIMETHOXYBENZOATE
859663028
COC1=C(C(=CC=C1)OC)C(=O)OC2=CC3=C(C=C2)C(=O)C(=CC4=CC5=CC=CC=C5OC4)O3
COc1cccc(c1C(=O)Oc1ccc2c(c1)OC(=CC1=Cc3c(OC1)cccc3)C2=O)OC
InChI=1SC27H20O7c1302185922(312)25(21)27(29)331810111923(1418)3424(26(19)28)13161217634720(17)321516h314H15H212H3b2413
MFCD06494711
ZINC000011865109
ZINC11865109

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Available files

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