Vitas-M small molecule compound
phenyl (6aR,6bS,9aR,10S)-7,9-dioxo-8-[3-(trifluoromethyl)phenyl]-6b,7,8,9,9a,10-hexahydro-6aH-pyrrolo[3',4':3,4]pyrrolo[1,2-a]quinoline-10-carboxylate
Catalog ID
STK541629
SMILES O=C([C@H]1N2[C@@H]([C@@H]3[C@H]1C(=O)N(C3=O)c1cccc(c1)C(F)(F)F)C=Cc1c2cccc1)Oc1ccccc1
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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 C28H19F3N2O4 MW 504.47 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H19F3N2O4/c29-28(30,31)17-8-6-9-18(15-17)32-25(34)22-21-14-13-16-7-4-5-12-20(16)33(21)24(23(22)26(32)35)27(36)37-19-10-2-1-3-11-19/h1-15,21-24H/t21-,22-,23-,24+/m1/s1InChIKey
ABYDLDQOJKOPIT-YCAMKHIRSA-NSynonyms
956938-28-6(6aR6bS9aR10S)phenyl79dioxo8(3(trifluoromethyl)phenyl)6b7899a10hexahydro6aHpyrrolo(3434)pyrrolo(12a)quinoline10carboxylate
956938286
C1=CC=C(C=C1)OC(=O)C2C3C(C4N2C5=CC=CC=C5C=C4)C(=O)N(C3=O)C6=CC=CC(=C6)C(F)(F)F
InChI=1SC28H19F3N2O4c2928(3031)1786918(1517)3225(34)22211413167451220(16)33(21)24(23(22)26(32)35)27(36)3719102131119h1152124Ht21222324+m1s1
MFCD18241916
O=C((C@H)1N2(C@@H)((C@@H)3(C@H)1C(=O)N(C3=O)c1cccc(c1)C(F)(F)F)C=Cc1c2cccc1)Oc1ccccc1
phenyl(6aR6bS9aR10S)79dioxo8(3(trifluoromethyl)phenyl)6b7899a10hexahydro6aHpyrrolo(3434)pyrrolo(12a)quinoline10carboxylate
ZINC000036006855
ZINC36006855
Check stock
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Check stock on Vitas-MAvailable files
Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.