Vitas-M small molecule compound
4,7,7-trimethyl-1-[(1,3,3-trimethyl-6-azabicyclo[3.2.1]oct-6-yl)carbonyl]-2-oxabicyclo[2.2.1]heptan-3-one
Catalog ID
STK967878
SMILES O=C(C12CCC(C2(C)C)(C(=O)O1)C)N1CC2(CC1CC(C2)(C)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 C20H31NO3 MW 333.47 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H31NO3/c1-16(2)9-13-10-18(5,11-16)12-21(13)14(22)20-8-7-19(6,15(23)24-20)17(20,3)4/h13H,7-12H2,1-6H3InChIKey
KUFRUMHEWLMNLW-UHFFFAOYSA-NSynonyms
(1R4S)477trimethyl1((1S5R)133trimethyl6azabicyclo(321)octane6carbonyl)2oxabicyclo(221)heptan3one
177TRIMETHYL4((133TRIMETHYL6AZABICYCLO(321)OCT6YL)CARBONYL)3OXABICYCLO(221)HEPTAN2ONE
177TRIMETHYL4(335TRIMETHYL7AZABICYCLO(321)OCTANE7CARBONYL)3OXABICYCLO(221)HEPTAN2ONE
477TRIMETHYL1((133TRIMETHYL6AZABICYCLO(321)OCT6YL)CARBONYL)2OXABICYCLO(221)HEPTAN3ONE
CC1(CC2CC(C1)(CN2C(=O)C34CCC(C3(C)C)(C(=O)O4)C)C)C
InChI=1SC20H31NO3c116(2)9131018(51116)1221(13)14(22)208719(615(23)2420)17(203)4h13H712H216H3
MFCD03147155
O=C(C12CCC(C2(C)C)(C(=O)O1)C)N1C(C@@)2(C(C@H)1CC(C2)(C)C)C
ZINC000101270860
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