Vitas-M small molecule compound
(2Z)-6-[(2,5-dimethylbenzyl)oxy]-2-[(5-methoxy-1-methyl-1H-indol-3-yl)methylidene]-7-methyl-1-benzofuran-3(2H)-one
Catalog ID
STK992803
SMILES COc1ccc2c(c1)c(/C=C/1\Oc3c(C1=O)ccc(c3C)OCc1cc(C)ccc1C)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 C29H27NO4 MW 453.54 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H27NO4/c1-17-6-7-18(2)21(12-17)16-33-26-11-9-23-28(31)27(34-29(23)19(26)3)13-20-15-30(4)25-10-8-22(32-5)14-24(20)25/h6-15H,16H2,1-5H3/b27-13-InChIKey
NJZNQSGWKHTXQP-WKIKZPBSSA-NSynonyms
(2Z)6((25dimethylbenzyl)oxy)2((5methoxy1methyl1Hindol3yl)methylidene)7methyl1benzofuran3(2H)one
(2Z)6((25dimethylphenyl)methoxy)2((5methoxy1methylindol3yl)methylidene)7methyl1benzofuran3one
(E)6((25dimethylbenzyl)oxy)2((5methoxy1methyl1Hindol3yl)methylene)7methylbenzofuran3(2H)one
6((25DIMETHYLPHENYL)METHOXY)2((5METHOXY1METHYLINDOL3YL)METHYLENE)7METHYLBENZO(B)FURAN3ONE
CC1=CC(=C(C=C1)C)COC2=C(C3=C(C=C2)C(=O)C(=CC4=CN(C5=C4C=C(C=C5)OC)C)O3)C
COc1ccc2c(c1)c(C=C1Oc3c(C1=O)ccc(c3C)OCc1cc(C)ccc1C)cn2C
InChI=1SC29H27NO4c1176718(2)21(1217)1633261192328(31)27(3429(23)19(26)3)13201530(4)2510822(325)1424(20)25h615H16H215H3b2713
MFCD18184640
ZINC000028182485
ZINC28182485
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