Vitas-M small molecule compound
(2Z)-8-(tetrahydrofuran-2-ylmethyl)-2-(3,4,5-trimethoxybenzylidene)-8,9-dihydro-7H-furo[2,3-f][1,3]benzoxazin-3(2H)-one
Catalog ID
STK621257
SMILES COc1cc(/C=C/2\Oc3c(C2=O)ccc2c3CN(CO2)CC2CCCO2)cc(c1OC)OC
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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 C25H27NO7 MW 453.49 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H27NO7/c1-28-21-10-15(11-22(29-2)25(21)30-3)9-20-23(27)17-6-7-19-18(24(17)33-20)13-26(14-32-19)12-16-5-4-8-31-16/h6-7,9-11,16H,4-5,8,12-14H2,1-3H3/b20-9-InChIKey
UIGIOABCCPHSKN-UKWGHVSLSA-NSynonyms
951942-02-2(2Z)8(oxolan2ylmethyl)2((345trimethoxyphenyl)methylidene)79dihydrofuro(23f)(13)benzoxazin3one
(2Z)8(tetrahydrofuran2ylmethyl)2(345trimethoxybenzylidene)89dihydro7Hfuro(23f)(13)benzoxazin3(2H)one
(Z)8((tetrahydrofuran2yl)methyl)2(345trimethoxybenzylidene)89dihydro2Hbenzofuro(76e)(13)oxazin3(7H)one
951942022
COC1=CC(=CC(=C1OC)OC)C=C2C(=O)C3=C(O2)C4=C(C=C3)OCN(C4)CC5CCCO5
COc1cc(C=C2Oc3c(C2=O)ccc2c3CN(CO2)CC2CCCO2)cc(c1OC)OC
InChI=1SC25H27NO7c128211015(1122(292)25(21)303)92023(27)17671918(24(17)3320)1326(143219)12165483116h6791116H4581214H213H3b209
MFCD09855312
ZINC000013722031
ZINC000013722034
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