Vitas-M small molecule compound
2-methylbut-3-yn-2-yl [(5R)-8-oxo-1,5,6,8-tetrahydro-2H-1,5-methanopyrido[1,2-a][1,5]diazocin-3(4H)-yl]acetate
Catalog ID
STL526865
SMILES C#CC(OC(=O)CN1C[C@H]2CC(C1)c1n(C2)c(=O)ccc1)(C)C
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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 C18H22N2O3 MW 314.38 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H22N2O3/c1-4-18(2,3)23-17(22)12-19-9-13-8-14(11-19)15-6-5-7-16(21)20(15)10-13/h1,5-7,13-14H,8-12H2,2-3H3/t13-,14?/m0/s1InChIKey
VSBGTVQMBMNZPL-LSLKUGRBSA-NSynonyms
2methylbut3yn2yl((5R)8oxo1568tetrahydro2H15methanopyrido(12a)(15)diazocin3(4H)yl)acetate
2methylbut3yn2yl2((1R5S)8oxo56dihydro1H15methanopyrido(12a)(15)diazocin3(2H4H8H)yl)acetatehydrochloride
C#CC(OC(=O)CN1C(C@@H)2C(C@H)(C1)c1n(C2)c(=O)ccc1)(C)CCl
InChI=1SC18H22N2O3c1418(23)2317(22)1219913814(1119)1565716(21)20(15)1013h1571314H812H223H3t1314?m0s1
MFCD03006510
ZINC000100746871
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