Vitas-M small molecule compound
4-[11-(3-methoxy-4-propoxyphenyl)-3,3-dimethyl-1-oxo-1,2,3,4,5,11-hexahydro-10H-dibenzo[b,e][1,4]diazepin-10-yl]-4-oxobutanoic acid
Catalog ID
STL444589
SMILES CCCOc1ccc(cc1OC)C1C2=C(Nc3c(N1C(=O)CCC(=O)O)cccc3)CC(CC2=O)(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 C29H34N2O6 MW 506.60 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H34N2O6/c1-5-14-37-23-11-10-18(15-24(23)36-4)28-27-20(16-29(2,3)17-22(27)32)30-19-8-6-7-9-21(19)31(28)25(33)12-13-26(34)35/h6-11,15,28,30H,5,12-14,16-17H2,1-4H3,(H,34,35)InChIKey
DGCKDRKRTDKKPI-UHFFFAOYSA-NSynonyms
675142-18-44(11(3METHOXY4PROPOXYPHENYL)33DIMETHYL1OXO(234TRIHYDRO5H11HBENZO(B)BENZO(21F)14DIAZEPIN10YL))4OXOBUTANOICACID
4(11(3methoxy4propoxyphenyl)33dimethyl1oxo1234511hexahydro10Hdibenzo(be)(14)diazepin10yl)4oxobutanoicacid
4(6(3methoxy4propoxyphenyl)99dimethyl7oxo681011tetrahydrobenzo(b)(14)benzodiazepin5yl)4oxobutanoicacid
675142184
CCCOC1=C(C=C(C=C1)C2C3=C(CC(CC3=O)(C)C)NC4=CC=CC=C4N2C(=O)CCC(=O)O)OC
InChI=1SC29H34N2O6c15143723111018(1524(23)364)282720(1629(23)1722(27)32)3019867921(19)31(28)25(33)121326(34)35h611152830H512141617H214H3(H3435)
MFCD03488611
ZINC000008695575
ZINC000008695576
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