Vitas-M small molecule compound
5-{6-[(4-chlorophenyl)carbonyl]-5-hydroxy-2-oxo-3,4-dihydro-2H-chromen-4-yl}-1,2-dihydro-4H-pyrrolo[3,2,1-ij]quinolin-4-one
Catalog ID
STL546539
SMILES O=C1Oc2ccc(c(c2C(C1)c1cc2cccc3c2n(c1=O)CC3)O)C(=O)c1ccc(cc1)Cl
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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 C27H18ClNO5 MW 471.90 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H18ClNO5/c28-17-6-4-15(5-7-17)25(31)18-8-9-21-23(26(18)32)19(13-22(30)34-21)20-12-16-3-1-2-14-10-11-29(24(14)16)27(20)33/h1-9,12,19,32H,10-11,13H2InChIKey
UWOLTNUPKHJSSI-UHFFFAOYSA-NSynonyms
10(6(4chlorobenzoyl)5hydroxy2oxo34dihydrochromen4yl)1azatricyclo(6310^(412))dodeca468(12)9tetraen11one
122170190
5(6((4chlorophenyl)carbonyl)5hydroxy2oxo34dihydro2Hchromen4yl)12dihydro4Hpyrrolo(321ij)quinolin4one
5(6(4chlorobenzoyl)5hydroxy2oxochroman4yl)1Hpyrrolo(321ij)quinolin4(2H)one
InChI=1SC27H18ClNO5c28176415(5717)25(31)18892123(26(18)32)19(1322(30)3421)20121631214101129(24(14)16)27(20)33h19121932H101113H2
MFCD31756423
ZINC000409415636
ZINC000409415637
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