Vitas-M small molecule compound
methyl 4-[(Z)-{6-[(3-methylbut-2-en-1-yl)oxy]-3-oxo-1-benzofuran-2(3H)-ylidene}methyl]benzoate
Catalog ID
STK923530
SMILES COC(=O)c1ccc(cc1)/C=C/1\Oc2c(C1=O)ccc(c2)OCC=C(C)C
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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 C22H20O5 MW 364.40 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H20O5/c1-14(2)10-11-26-17-8-9-18-19(13-17)27-20(21(18)23)12-15-4-6-16(7-5-15)22(24)25-3/h4-10,12-13H,11H2,1-3H3/b20-12-InChIKey
MQHPUTJGJBPVBB-NDENLUEZSA-NSynonyms
858757-68-3(Z)methyl4((6((3methylbut2en1yl)oxy)3oxobenzofuran2(3H)ylidene)methyl)benzoate
858757683
CC(=CCOC1=CC2=C(C=C1)C(=O)C(=CC3=CC=C(C=C3)C(=O)OC)O2)C
COC(=O)c1ccc(cc1)C=C1Oc2c(C1=O)ccc(c2)OCC=C(C)C
InChI=1SC22H20O5c114(2)10112617891819(1317)2720(21(18)23)12154616(7515)22(24)253h4101213H11H213H3b2012
METHYL4((6(3METHYLBUT2ENYLOXY)3OXOBENZO(D)FURAN2YLIDENE)METHYL)BENZOATE
methyl4((Z)(6((3methylbut2en1yl)oxy)3oxo1benzofuran2(3H)ylidene)methyl)benzoate
METHYL4((Z)(6(3METHYLBUT2ENOXY)3OXO1BENZOFURAN2YLIDENE)METHYL)BENZOATE
MFCD04142579
ZINC000012662417
ZINC12662417
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