Vitas-M small molecule compound
ethyl 5-amino-1-((3aR,4R,6R,6aR)-6-(hydroxymethyl)-2,2-dimethyltetrahydrofuro[3,4-d][1,3]dioxol-4-yl)-1H-imidazole-4-carboxylate
Catalog ID
STL528036
SMILES CCOC(=O)c1ncn(c1N)[C@@H]1O[C@@H](C2C1OC(O2)(C)C)CO
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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 C14H21N3O6 MW 327.34 g/mol Purity >90% as per NMR
InChI
InChI=1S/C14H21N3O6/c1-4-20-13(19)8-11(15)17(6-16-8)12-10-9(7(5-18)21-12)22-14(2,3)23-10/h6-7,9-10,12,18H,4-5,15H2,1-3H3/t7-,9?,10?,12-/m1/s1InChIKey
QNYWKJPANMXTCT-WDHXSWFYSA-NSynonyms
16398521
CCOC(=O)c1ncn(c1N)(C@@H)1O(C@@H)((C@@H)2(C@H)1OC(O2)(C)C)CO
ethyl5amino1((3aR4R6R6aR)6(hydroxymethyl)22dimethyltetrahydrofuro(34d)(13)dioxol4yl)1Himidazole4carboxylate
ethyl5amino1((4~(R)6~(R))6(hydroxymethyl)22dimethyl3~(a)466~(a)tetrahydrofuro(34d)(13)dioxol4yl)imidazole4carboxylate
InChI=1SC14H21N3O6c142013(19)811(15)17(6168)12109(7(518)2112)2214(23)2310h679101218H4515H213H3t79?10?12m1s1
ZINC000003984922
ZINC000012661725
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