Vitas-M small molecule compound
(1R,9aR)-1-({[hydroxy(diphenyl)acetyl]oxy}methyl)-5-methyloctahydro-2H-quinolizinium
Catalog ID
STL553059
SMILES O=C(C(c1ccccc1)(c1ccccc1)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 C25H32NO3 MW 394.53 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H32NO3/c1-26-17-9-8-16-23(26)20(11-10-18-26)19-29-24(27)25(28,21-12-4-2-5-13-21)22-14-6-3-7-15-22/h2-7,12-15,20,23,28H,8-11,16-19H2,1H3/q+1/t20-,23+,26?/m0/s1InChIKey
SPIFXQQJEWETEO-VEMNNVBWSA-NSynonyms
((1~(R)9~(a)~(R))5methyl23467899~(a)octahydro1~(H)quinolizin5ium1yl)methyl2hydroxy22diphenylacetate
(1R9aR)1(((hydroxy(diphenyl)acetyl)oxy)methyl)5methyloctahydro2Hquinolizinium
(1R9aR)1((2hydroxy22diphenylacetoxy)methyl)5methyldecahydroquinolizin5iumiodide
6985598
InChI=1SC25H32NO3c12617981623(26)20(11101826)192924(27)25(2821124251321)22146371522h271215202328H8111619H21H3q+1t2023+26?m0s1
O=C(C(c1ccccc1)(c1ccccc1)O)OC(C@@H)1CCC(N+)2((C@@H)1CCCC2)C(I)
ZINC000252441376
ZINC000252441377
ZINC4039802
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