Vitas-M small molecule compound
(6bR,8S,11R,11aS)-12-[(4-fluorophenyl)carbonyl]-6a,6b,10,11,11a,12-hexahydro-8,11-epoxyoxepino[4',5':3,4]pyrrolo[1,2-a]quinolin-7(8H)-one
Catalog ID
STK672615
SMILES O=C1[C@H]2OC[C@H](O2)[C@H]2[C@@H]1C1C=Cc3c(N1C2C(=O)c1ccc(cc1)F)cccc3
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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 C23H18FNO4 MW 391.40 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H18FNO4/c24-14-8-5-13(6-9-14)21(26)20-19-17-11-28-23(29-17)22(27)18(19)16-10-7-12-3-1-2-4-15(12)25(16)20/h1-10,16-20,23H,11H2/t16?,17-,18-,19-,20?,23-/m0/s1InChIKey
FFBISRRZTPMMHX-ZHXGFRARSA-NSynonyms
(6bR8S11R11aS)12((4fluorophenyl)carbonyl)6a6b101111a12hexahydro811epoxyoxepino(4534)pyrrolo(12a)quinolin7(8H)one
C1C2C3C(C4C=CC5=CC=CC=C5N4C3C(=O)C6=CC=C(C=C6)F)C(=O)C(O1)O2
InChI=1SC23H18FNO4c24148513(6914)21(26)201917112823(2917)22(27)18(19)1610712312415(12)25(16)20h110162023H11H2t16?17181920?23m0s1
MFCD08141977
O=C1(C@H)2OC(C@H)(O2)(C@H)2(C@@H)1C1C=Cc3c(N1C2C(=O)c1ccc(cc1)F)cccc3
ZINC000006646108
ZINC000015161957
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