Vitas-M small molecule compound
(1R,9aR)-1-({[(2-methoxyphenyl)carbonyl]oxy}methyl)-5-methyloctahydro-2H-quinolizinium
Catalog ID
STL553402
SMILES COc1ccccc1C(=O)OC[C@@H]1CCC[N+]2([C@@H]1CCCC2)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 C19H28NO3 MW 318.44 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H28NO3/c1-20-12-6-5-10-17(20)15(8-7-13-20)14-23-19(21)16-9-3-4-11-18(16)22-2/h3-4,9,11,15,17H,5-8,10,12-14H2,1-2H3/q+1/t15-,17+,20?/m0/s1InChIKey
CFJFXNJXCPLJIB-DAPIJDQBSA-NSynonyms
((1~(R)9~(a)~(R))5methyl23467899~(a)octahydro1~(H)quinolizin5ium1yl)methyl2methoxybenzoate
(1R9aR)1((((2methoxyphenyl)carbonyl)oxy)methyl)5methyloctahydro2Hquinolizinium
(1R9aR)1(((2methoxybenzoyl)oxy)methyl)5methyldecahydroquinolizin5iumiodide
7001766
COc1ccccc1C(=O)OC(C@@H)1CCC(N+)2((C@@H)1CCCC2)C(I)
InChI=1SC19H28NO3c12012651017(20)15(871320)142319(21)169341118(16)222h349111517H58101214H212H3q+1t1517+20?m0s1
ZINC000247633276
ZINC000247633280
ZINC4073155
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