Vitas-M small molecule compound
1'-[2-(3,4-dimethoxyphenyl)ethyl]-2'-hydroxy-13-methyl-1,2,3,4,5,5a-hexahydro-4'H,7H,8H-spiro[pyrido[1'',2'':1',2']pyrimido[5',4':5,6]pyrido[1,2-a]azepine-6,5'-pyrimidine]-4',6',8(1'H)-trione
Catalog ID
STK584492
SMILES COc1ccc(cc1OC)CCN1C(=NC(=O)C2(C1=O)Cc1c(N3C2CCCCC3)nc2n(c1=O)cccc2C)O
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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 C30H33N5O6 MW 559.62 g/mol Purity >90% as per NMR
InChI
InChI=1S/C30H33N5O6/c1-18-8-7-14-34-24(18)31-25-20(26(34)36)17-30(23-9-5-4-6-13-33(23)25)27(37)32-29(39)35(28(30)38)15-12-19-10-11-21(40-2)22(16-19)41-3/h7-8,10-11,14,16,23H,4-6,9,12-13,15,17H2,1-3H3,(H,32,37,39)InChIKey
KRUPUMUBIVHADI-UHFFFAOYSA-NSynonyms
879478-10-11(2(34dimethoxyphenyl)ethyl)2hydroxy13methyl123455ahexahydro4H7H8Hspiro(pyrido(1212)pyrimido(5456)pyrido(12a)azepine65pyrimidine)468(1H)trione
879478101
MFCD07212729
ZINC000101670312
ZINC000101670326
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