Vitas-M small molecule compound
1-{1-hydroxy-3,3-dimethyl-11-[(2,2,3-trimethylcyclopent-3-en-1-yl)methyl]-2,3,4,11-tetrahydro-10H-dibenzo[b,e][1,4]diazepin-10-yl}ethanone
Catalog ID
STL528517
SMILES OC1=C2C(=Nc3c(N(C2CC2CC=C(C2(C)C)C)C(=O)C)cccc3)CC(C1)(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 C26H34N2O2 MW 406.57 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H34N2O2/c1-16-11-12-18(26(16,5)6)13-22-24-20(14-25(3,4)15-23(24)30)27-19-9-7-8-10-21(19)28(22)17(2)29/h7-11,18,22,30H,12-15H2,1-6H3InChIKey
ALVSXBNVSPRINX-UHFFFAOYSA-NSynonyms
1(1hydroxy33dimethyl11((223trimethylcyclopent3en1yl)methyl)23411tetrahydro10Hdibenzo(be)(14)diazepin10yl)ethanone
InChI=1SC26H34N2O2c116111218(26(165)6)13222420(1425(34)1523(24)30)27199781021(19)28(22)17(2)29h711182230H1215H216H3
MFCD03816318
ZINC000103971965
ZINC000103971978
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