Vitas-M small molecule compound
(1R,9aR)-octahydro-2H-quinolizin-1-ylmethyl 6-bromo-2-oxo-2H-chromene-3-carboxylate
Catalog ID
STK675428
SMILES Brc1ccc2c(c1)cc(c(=O)o2)C(=O)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 C20H22BrNO4 MW 420.30 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H22BrNO4/c21-15-6-7-18-14(10-15)11-16(20(24)26-18)19(23)25-12-13-4-3-9-22-8-2-1-5-17(13)22/h6-7,10-11,13,17H,1-5,8-9,12H2/t13-,17+/m0/s1InChIKey
AITKOWBLVUPZPO-SUMWQHHRSA-NSynonyms
((1R9aR)23467899aoctahydro1Hquinolizin1yl)methyl6bromo2oxochromene3carboxylate
(1R9AR)OCTAHYDRO2HQUINOLIZIN1YLMETHYL6BROMO2OXO2HCHROMENE3CARBOXYLATE
Brc1ccc2c(c1)cc(c(=O)o2)C(=O)OC(C@@H)1CCCN2(C@@H)1CCCC2
C1CCN2CCCC(C2C1)COC(=O)C3=CC4=C(C=CC(=C4)Br)OC3=O
InChI=1SC20H22BrNO4c2115671814(1015)1116(20(24)2618)19(23)25121343922821517(13)22h6710111317H158912H2t1317+m0s1
MFCD18246864
ZINC000015188654
ZINC15188654
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