Vitas-M small molecule compound
8-[(2E)-2-(5-bromo-3-oxo-1-propyl-1,3-dihydro-2H-indol-2-ylidene)hydrazinyl]adenosine
Catalog ID
STL540732
SMILES CCCN1/C(=N/Nc2nc3c(n2[C@@H]2O[C@@H]([C@H]([C@H]2O)O)CO)ncnc3N)/C(=O)c2c1ccc(c2)Br
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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 C21H23BrN8O5 MW 547.37 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H23BrN8O5/c1-2-5-29-11-4-3-9(22)6-10(11)14(32)19(29)27-28-21-26-13-17(23)24-8-25-18(13)30(21)20-16(34)15(33)12(7-31)35-20/h3-4,6,8,12,15-16,20,31,33-34H,2,5,7H2,1H3,(H,26,28)(H2,23,24,25)/b27-19+/t12-,15-,16-,20-/m1/s1InChIKey
OXCBQXJQMVFCHN-ZQCOSANCSA-NSynonyms
(Z)2(2(6amino9((2R3R4S5R)34dihydroxy5(hydroxymethyl)tetrahydrofuran2yl)9Hpurin8yl)hydrazono)5bromo1propylindolin3one
8((2E)2(5bromo3oxo1propyl13dihydro2Hindol2ylidene)hydrazinyl)adenosine
CCCN1C(=NNc2nc3c(n2(C@@H)2O(C@@H)((C@H)((C@H)2O)O)CO)ncnc3N)C(=O)c2c1ccc(c2)Br
InChI=1SC21H23BrN8O5c1252911439(22)610(11)14(32)19(29)272821261317(23)2482518(13)30(21)2016(34)15(33)12(731)3520h346812151620313334H257H21H3(H2628)(H2232425)b2719+t12151620m1s1
ZINC000005946722
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