Vitas-M small molecule compound
4-{3-(3,4-dimethoxyphenyl)-1-hydroxy-11-[4-(methoxycarbonyl)phenyl]-2,3,4,11-tetrahydro-10H-dibenzo[b,e][1,4]diazepin-5-ium-10-yl}-4-oxobutanoate
Catalog ID
STL528356
SMILES COC(=O)c1ccc(cc1)C1C2=C(O)CC(CC2=[NH+]c2c(N1C(=O)CCC(=O)[O-])cccc2)c1ccc(c(c1)OC)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 C33H32N2O8 MW 584.63 g/mol Purity >90% as per NMR
InChI
InChI=1S/C33H32N2O8/c1-41-27-13-12-21(18-28(27)42-2)22-16-24-31(26(36)17-22)32(19-8-10-20(11-9-19)33(40)43-3)35(29(37)14-15-30(38)39)25-7-5-4-6-23(25)34-24/h4-13,18,22,32,36H,14-17H2,1-3H3,(H,38,39)InChIKey
MTMQDVRIZDKYER-UHFFFAOYSA-NSynonyms
4(3(34dimethoxyphenyl)1hydroxy11(4(methoxycarbonyl)phenyl)23411tetrahydro10Hdibenzo(be)(14)diazepin5ium10yl)4oxobutanoate
54690312
MFCD03312750
ZINC000001322685
Check stock
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