Vitas-M small molecule compound
4-[3-(4-tert-butylphenyl)-11-(3,4-dimethoxyphenyl)-1-hydroxy-2,3,4,11-tetrahydro-10H-dibenzo[b,e][1,4]diazepin-10-yl]-4-oxobutanoic acid
Catalog ID
STK034765
SMILES COc1cc(ccc1OC)C1C2=C(O)CC(CC2=Nc2c(N1C(=O)CCC(=O)O)cccc2)c1ccc(cc1)C(C)(C)C
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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 C35H38N2O6 MW 582.70 g/mol Purity >90% as per NMR
InChI
InChI=1S/C35H38N2O6/c1-35(2,3)24-13-10-21(11-14-24)23-18-26-33(28(38)19-23)34(22-12-15-29(42-4)30(20-22)43-5)37(31(39)16-17-32(40)41)27-9-7-6-8-25(27)36-26/h6-15,20,23,34,38H,16-19H2,1-5H3,(H,40,41)InChIKey
UCYDEMADQPKPAG-UHFFFAOYSA-NSynonyms
4(3(4(tertbutyl)phenyl)11(34dimethoxyphenyl)1hydroxy34dihydro2Hdibenzo(be)(14)diazepin10(11H)yl)4oxobutanoicacid
4(3(4tertbutylphenyl)11(34dimethoxyphenyl)1hydroxy23411tetrahydro10Hdibenzo(be)(14)diazepin10yl)4oxobutanoicacid
COc1cc(ccc1OC)C1C2=C(O)CC(CC2=Nc2c(N1C(=O)CCC(=O)O)cccc2)c1ccc(cc1)C(C)(C)C
MFCD03194709
STK034765
ZINC000100426119
ZINC000100426131
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