Vitas-M small molecule compound
benzyl ({(2Z)-2-[(5-methoxy-1-methyl-1H-indol-3-yl)methylidene]-7-methyl-3-oxo-2,3-dihydro-1-benzofuran-6-yl}oxy)acetate
Catalog ID
STK992946
SMILES COc1ccc2c(c1)c(/C=C/1\Oc3c(C1=O)ccc(c3C)OCC(=O)OCc1ccccc1)cn2C
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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 C29H25NO6 MW 483.52 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H25NO6/c1-18-25(34-17-27(31)35-16-19-7-5-4-6-8-19)12-10-22-28(32)26(36-29(18)22)13-20-15-30(2)24-11-9-21(33-3)14-23(20)24/h4-15H,16-17H2,1-3H3/b26-13-InChIKey
PDHBFABNBLEQQP-ZMFRSBBQSA-NSynonyms
(E)benzyl2((2((5methoxy1methyl1Hindol3yl)methylene)7methyl3oxo23dihydrobenzofuran6yl)oxy)acetate
benzyl(((2Z)2((5methoxy1methyl1Hindol3yl)methylidene)7methyl3oxo23dihydro1benzofuran6yl)oxy)acetate
benzyl2(((2Z)2((5methoxy1methylindol3yl)methylidene)7methyl3oxo1benzofuran6yl)oxy)acetate
CC1=C(C=CC2=C1OC(=CC3=CN(C4=C3C=C(C=C4)OC)C)C2=O)OCC(=O)OCC5=CC=CC=C5
COc1ccc2c(c1)c(C=C1Oc3c(C1=O)ccc(c3C)OCC(=O)OCc1ccccc1)cn2C
InChI=1SC29H25NO6c11825(341727(31)3516197546819)12102228(32)26(3629(18)22)13201530(2)2411921(333)1423(20)24h415H1617H213H3b2613
MFCD18184755
PHENYLMETHYL2(2((5METHOXY1METHYLINDOL3YL)METHYLENE)7METHYL3OXOBENZO(34B)FURAN6YLOXY)ACETATE
ZINC000028182718
ZINC28182718
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