Vitas-M small molecule compound

(2Z)-2-(2H-chromen-3-ylmethylidene)-3-oxo-2,3-dihydro-1-benzofuran-6-yl 3,5-dimethoxybenzoate

Catalog ID
STL033262
SMILES COc1cc(OC)cc(c1)C(=O)Oc1ccc2c(c1)O/C(=C\C1=Cc3c(OC1)cccc3)/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 C27H20O7 MW 456.45 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H20O7/c1-30-20-11-18(12-21(13-20)31-2)27(29)33-19-7-8-22-24(14-19)34-25(26(22)28)10-16-9-17-5-3-4-6-23(17)32-15-16/h3-14H,15H2,1-2H3/b25-10-
InChIKey
UYDFFGGNQIGJFS-MRUKODCESA-N
Synonyms
859130-97-5
((2Z)2(2HCHROMEN3YLMETHYLIDENE)3OXO1BENZOFURAN6YL)35DIMETHOXYBENZOATE
(2Z)2(2Hchromen3ylmethylidene)3oxo23dihydro1benzofuran6yl35dimethoxybenzoate
(Z)2((2Hchromen3yl)methylene)3oxo23dihydrobenzofuran6yl35dimethoxybenzoate
2(2HCHROMEN3YLMETHYLENE)3OXOBENZO(34B)FURAN6YL35DIMETHOXYBENZOATE
859130975
COC1=CC(=CC(=C1)C(=O)OC2=CC3=C(C=C2)C(=O)C(=CC4=CC5=CC=CC=C5OC4)O3)OC
COc1cc(OC)cc(c1)C(=O)Oc1ccc2c(c1)OC(=CC1=Cc3c(OC1)cccc3)C2=O
InChI=1SC27H20O7c130201118(1221(1320)312)27(29)3319782224(1419)3425(26(22)28)1016917534623(17)321516h314H15H212H3b2510
MFCD06492602
ZINC000011865111
ZINC11865111

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Available files

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