Vitas-M small molecule compound

(2Z)-2-(4-tert-butylbenzylidene)-3-oxo-2,3-dihydro-1-benzofuran-6-yl 3,4-dimethoxybenzoate

Catalog ID
STK924463
SMILES COc1ccc(cc1OC)C(=O)Oc1ccc2c(c1)O/C(=C\c1ccc(cc1)C(C)(C)C)/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 C28H26O6 MW 458.51 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H26O6/c1-28(2,3)19-9-6-17(7-10-19)14-25-26(29)21-12-11-20(16-23(21)34-25)33-27(30)18-8-13-22(31-4)24(15-18)32-5/h6-16H,1-5H3/b25-14-
InChIKey
XGZCBBSSZKYRCY-QFEZKATASA-N
Synonyms
622792-27-2
((2Z)2((4TERTBUTYLPHENYL)METHYLIDENE)3OXO1BENZOFURAN6YL)34DIMETHOXYBENZOATE
(2Z)2(4tertbutylbenzylidene)3oxo23dihydro1benzofuran6yl34dimethoxybenzoate
(Z)2(4(tertbutyl)benzylidene)3oxo23dihydrobenzofuran6yl34dimethoxybenzoate
2((4(TERTBUTYL)PHENYL)METHYLENE)3OXOBENZO(34B)FURAN6YL34DIMETHOXYBENZOATE
622792272
CC(C)(C)C1=CC=C(C=C1)C=C2C(=O)C3=C(O2)C=C(C=C3)OC(=O)C4=CC(=C(C=C4)OC)OC
COc1ccc(cc1OC)C(=O)Oc1ccc2c(c1)OC(=Cc1ccc(cc1)C(C)(C)C)C2=O
InChI=1SC28H26O6c128(23)199617(71019)142526(29)21121120(1623(21)3425)3327(30)1881322(314)24(1518)325h616H15H3b2514
MFCD04196251
ZINC000002434879
ZINC02434879
ZINC2434879

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Available files

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