Vitas-M small molecule compound
1-heptyl-2,6-dihydroxy-5-(2,3,4,9-tetrahydro-1H-beta-carbolin-1-yl)pyrimidin-4(1H)-one
Catalog ID
STL531341
SMILES CCCCCCCn1c(O)nc(=O)c(c1O)C1NCCc2c1[nH]c1c2cccc1
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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 C22H28N4O3 MW 396.49 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H28N4O3/c1-2-3-4-5-8-13-26-21(28)17(20(27)25-22(26)29)19-18-15(11-12-23-19)14-9-6-7-10-16(14)24-18/h6-7,9-10,19,23-24,28H,2-5,8,11-13H2,1H3,(H,25,27,29)InChIKey
DKFYTHCNOOWZEK-UHFFFAOYSA-NSynonyms
939356-11-31heptyl26dihydroxy5(2349tetrahydro1Hbetacarbolin1yl)pyrimidin4(1H)one
1heptyl6hydroxy5(2349tetrahydro1~(H)pyrido(34b)indol1yl)pyrimidine24dione
4834003
939356113
InChI=1SC22H28N4O3c123458132621(28)17(20(27)2522(26)29)191815(11122319)149671016(14)2418h6791019232428H2581113H21H3(H252729)
MFCD07199178
ZINC000070692086
ZINC000070692087
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