Vitas-M small molecule compound
(1R,9aR)-octahydro-2H-quinolizin-1-ylmethyl (2E)-4-oxo-4-phenylbut-2-enoate
Catalog ID
STL562900
SMILES O=C(/C=C/C(=O)c1ccccc1)OC[C@@H]1CCCN2[C@@H]1CCCC2
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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 C20H25NO3 MW 327.42 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H25NO3/c22-19(16-7-2-1-3-8-16)11-12-20(23)24-15-17-9-6-14-21-13-5-4-10-18(17)21/h1-3,7-8,11-12,17-18H,4-6,9-10,13-15H2/b12-11+/t17-,18+/m0/s1InChIKey
IIAHFBKBTSDKEN-AAIOHFERSA-NSynonyms
((1R9aR)23467899aoctahydro1Hquinolizin1yl)methyl(E)4oxo4phenylbut2enoate
(1R9aR)octahydro2Hquinolizin1ylmethyl(2E)4oxo4phenylbut2enoate
(E)((1R9aR)octahydro1Hquinolizin1yl)methyl4oxo4phenylbut2enoate
11875392
InChI=1SC20H25NO3c2219(167213816)111220(23)24151796142113541018(17)21h137811121718H469101315H2b1211+t1718+m0s1
MFCD32651371
O=C(C=CC(=O)c1ccccc1)OC(C@@H)1CCCN2(C@@H)1CCCC2
ZINC000004064030
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