Vitas-M small molecule compound
(5S,6R,9S,10S)-2-(pyridin-4-yl)-9,10-dihydro-4H,8H-6,9-epoxy-5,10-methano[1,2,4]triazolo[5,1-e][1,4,6]oxadiazonin-5(6H)-ol
Catalog ID
STK681179
SMILES O[C@]12C[C@@H]([C@@H]3O[C@H]2OC3)n2c(N1)nc(n2)c1ccncc1
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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 C13H13N5O3 MW 287.28 g/mol Purity >90% as per NMR
InChI
InChI=1S/C13H13N5O3/c19-13-5-8(9-6-20-11(13)21-9)18-12(16-13)15-10(17-18)7-1-3-14-4-2-7/h1-4,8-9,11,19H,5-6H2,(H,15,16,17)/t8-,9+,11+,13-/m0/s1InChIKey
QOEOZTISZNOAIP-JQEKQURRSA-NSynonyms
(5S6R9S10S)2(pyridin4yl)910dihydro4H8H69epoxy510methano(124)triazolo(51e)(146)oxadiazonin5(6H)ol
C1C2C3COC(C1(N=C4N2NC(=N4)C5=CC=NC=C5)O)O3
InChI=1SC13H13N5O3c191358(962011(13)219)1812(1613)1510(1718)71314427h14891119H56H2(H151617)t89+11+13m0s1
MFCD18246885
O(C@)12C(C@@H)((C@@H)3O(C@H)2OC3)n2c(N1)nc(n2)c1ccncc1
ZINC000006659622
ZINC06659622
ZINC6659622
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