Vitas-M small molecule compound
3-(4-methoxyphenyl)-10-(3-methylbutanoyl)-11-(3,4,5-trimethoxyphenyl)-2,3,4,5,10,11-hexahydro-1H-dibenzo[b,e][1,4]diazepin-1-one
Catalog ID
STK546476
SMILES COc1ccc(cc1)C1CC(=O)C2=C(C1)Nc1ccccc1N(C2c1cc(OC)c(c(c1)OC)OC)C(=O)CC(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 C34H38N2O6 MW 570.69 g/mol Purity >90% as per NMR
InChI
InChI=1S/C34H38N2O6/c1-20(2)15-31(38)36-27-10-8-7-9-25(27)35-26-16-22(21-11-13-24(39-3)14-12-21)17-28(37)32(26)33(36)23-18-29(40-4)34(42-6)30(19-23)41-5/h7-14,18-20,22,33,35H,15-17H2,1-6H3InChIKey
HAMHICGBAONEIL-UHFFFAOYSA-NSynonyms
3(4methoxyphenyl)10(3methylbutanoyl)11(345trimethoxyphenyl)23451011hexahydro1Hdibenzo(be)(14)diazepin1one
9(4methoxyphenyl)5(3methylbutanoyl)6(345trimethoxyphenyl)891011tetrahydro6Hbenzo(b)(14)benzodiazepin7one
CC(C)CC(=O)N1C(C2=C(CC(CC2=O)C3=CC=C(C=C3)OC)NC4=CC=CC=C41)C5=CC(=C(C(=C5)OC)OC)OC
InChI=1SC34H38N2O6c120(2)1531(38)36271087925(27)35261622(21111324(393)141221)1728(37)32(26)33(36)231829(404)34(426)30(1923)415h7141820223335H1517H216H3
MFCD03293010
ZINC000098000284
ZINC000098000287
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