Vitas-M small molecule compound

benzyl {[(2Z)-2-(4-tert-butylbenzylidene)-3-oxo-2,3-dihydro-1-benzofuran-6-yl]oxy}acetate

Catalog ID
STK622075
SMILES O=C(OCc1ccccc1)COc1ccc2c(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 C28H26O5 MW 442.51 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H26O5/c1-28(2,3)21-11-9-19(10-12-21)15-25-27(30)23-14-13-22(16-24(23)33-25)31-18-26(29)32-17-20-7-5-4-6-8-20/h4-16H,17-18H2,1-3H3/b25-15-
InChIKey
IQRUMJSJJLPXDB-MYYYXRDXSA-N
Synonyms
620548-29-0
(Z)benzyl2((2(4(tertbutyl)benzylidene)3oxo23dihydrobenzofuran6yl)oxy)acetate
620548290
benzyl(((2Z)2(4tertbutylbenzylidene)3oxo23dihydro1benzofuran6yl)oxy)acetate
BENZYL2(((2Z)2((4TERTBUTYLPHENYL)METHYLIDENE)3OXO1BENZOFURAN6YL)OXY)ACETATE
CC(C)(C)C1=CC=C(C=C1)C=C2C(=O)C3=C(O2)C=C(C=C3)OCC(=O)OCC4=CC=CC=C4
InChI=1SC28H26O5c128(23)2111919(101221)152527(30)23141322(1624(23)3325)311826(29)3217207546820h416H1718H213H3b2515
MFCD04180866
O=C(OCc1ccccc1)COc1ccc2c(c1)OC(=Cc1ccc(cc1)C(C)(C)C)C2=O
PHENYLMETHYL2(2((4(TERTBUTYL)PHENYL)METHYLENE)3OXOBENZO(34B)FURAN6YLOXY)ACETATE
ZINC000013656296
ZINC13656296

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Available files

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