Vitas-M small molecule compound
(2Z)-8-(3,4-dimethoxybenzyl)-2-(2,3-dimethoxybenzylidene)-8,9-dihydro-7H-furo[2,3-f][1,3]benzoxazin-3(2H)-one
Catalog ID
STK622217
SMILES COc1cc(ccc1OC)CN1COc2c(C1)c1O/C(=C\c3cccc(c3OC)OC)/C(=O)c1cc2
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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 C28H27NO7 MW 489.52 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H27NO7/c1-31-22-10-8-17(12-24(22)33-3)14-29-15-20-21(35-16-29)11-9-19-26(30)25(36-28(19)20)13-18-6-5-7-23(32-2)27(18)34-4/h5-13H,14-16H2,1-4H3/b25-13-InChIKey
CTMOSEOTILMPRM-MXAYSNPKSA-NSynonyms
951973-72-1(2Z)8((34dimethoxyphenyl)methyl)2((23dimethoxyphenyl)methylidene)79dihydrofuro(23f)(13)benzoxazin3one
(2Z)8(34dimethoxybenzyl)2(23dimethoxybenzylidene)89dihydro7Hfuro(23f)(13)benzoxazin3(2H)one
(Z)8(34dimethoxybenzyl)2(23dimethoxybenzylidene)89dihydro2Hbenzofuro(76e)(13)oxazin3(7H)one
951973721
COC1=C(C=C(C=C1)CN2CC3=C(C=CC4=C3OC(=CC5=C(C(=CC=C5)OC)OC)C4=O)OC2)OC
COc1cc(ccc1OC)CN1COc2c(C1)c1OC(=Cc3cccc(c3OC)OC)C(=O)c1cc2
InChI=1SC28H27NO7c1312210817(1224(22)333)1429152021(351629)1191926(30)25(3628(19)20)131865723(322)27(18)344h513H1416H214H3b2513
MFCD09858690
ZINC000013735113
ZINC13735113
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