Vitas-M small molecule compound
(8Z)-2-amino-8-(2,3,4-trimethoxybenzylidene)-4-(2,3,4-trimethoxyphenyl)-5,6,7,8-tetrahydro-4H-chromene-3-carbonitrile
Catalog ID
STL175773
SMILES COc1ccc(c(c1OC)OC)/C=C\1/CCCC2=C1OC(=C(C2c1ccc(c(c1OC)OC)OC)C#N)N
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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 C29H32N2O7 MW 520.58 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H32N2O7/c1-32-21-12-10-17(25(34-3)27(21)36-5)14-16-8-7-9-18-23(20(15-30)29(31)38-24(16)18)19-11-13-22(33-2)28(37-6)26(19)35-4/h10-14,23H,7-9,31H2,1-6H3/b16-14-InChIKey
IUEXOXZVBXMOFN-PEZBUJJGSA-NSynonyms
445259-72-3(8Z)2amino4(234trimethoxyphenyl)8((234trimethoxyphenyl)methylidene)4567tetrahydrochromene3carbonitrile
(8Z)2amino8(234trimethoxybenzylidene)4(234trimethoxyphenyl)5678tetrahydro4Hchromene3carbonitrile
445259723
COC1=C(C(=C(C=C1)C=C2CCCC3=C2OC(=C(C3C4=C(C(=C(C=C4)OC)OC)OC)C#N)N)OC)OC
COc1ccc(c(c1OC)OC)C=C1CCCC2=C1OC(=C(C2c1ccc(c(c1OC)OC)OC)C#N)N
InChI=1SC29H32N2O7c13221121017(25(343)27(21)365)14168791823(20(1530)29(31)3824(16)18)19111322(332)28(376)26(19)354h101423H7931H216H3b1614
MFCD03074685
ZINC000002111766
ZINC000002111770
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