Vitas-M small molecule compound

(2Z)-3-oxo-2-[4-(propan-2-yl)benzylidene]-2,3-dihydro-1-benzofuran-6-yl 2,6-dimethoxybenzoate

Catalog ID
STK923728
SMILES COc1cccc(c1C(=O)Oc1ccc2c(c1)O/C(=C\c1ccc(cc1)C(C)C)/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 C27H24O6 MW 444.48 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H24O6/c1-16(2)18-10-8-17(9-11-18)14-24-26(28)20-13-12-19(15-23(20)33-24)32-27(29)25-21(30-3)6-5-7-22(25)31-4/h5-16H,1-4H3/b24-14-
InChIKey
PBXOTQWYLMQFLF-OYKKKHCWSA-N
Synonyms
858763-97-0
((2Z)3OXO2((4PROPAN2YLPHENYL)METHYLIDENE)1BENZOFURAN6YL)26DIMETHOXYBENZOATE
(2Z)3oxo2(4(propan2yl)benzylidene)23dihydro1benzofuran6yl26dimethoxybenzoate
(Z)2(4isopropylbenzylidene)3oxo23dihydrobenzofuran6yl26dimethoxybenzoate
2((4(METHYLETHYL)PHENYL)METHYLENE)3OXOBENZO(34B)FURAN6YL26DIMETHOXYBENZOATE
858763970
CC(C)C1=CC=C(C=C1)C=C2C(=O)C3=C(O2)C=C(C=C3)OC(=O)C4=C(C=CC=C4OC)OC
COc1cccc(c1C(=O)Oc1ccc2c(c1)OC(=Cc1ccc(cc1)C(C)C)C2=O)OC
InChI=1SC27H24O6c116(2)1810817(91118)142426(28)20131219(1523(20)3324)3227(29)2521(303)65722(25)314h516H14H3b2414
MFCD04143073
ZINC000002098394
ZINC02098394
ZINC2098394

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Available files

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