Vitas-M small molecule compound
methyl 3-{3-[(4-chlorophenyl)carbonyl]-2,6-dihydroxyphenyl}-3-(4-oxo-1,2-dihydro-4H-pyrrolo[3,2,1-ij]quinolin-5-yl)propanoate
Catalog ID
STL548635
SMILES COC(=O)CC(c1cc2cccc3c2n(c1=O)CC3)c1c(O)ccc(c1O)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 C28H22ClNO6 MW 503.94 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H22ClNO6/c1-36-23(32)14-20(21-13-17-4-2-3-15-11-12-30(25(15)17)28(21)35)24-22(31)10-9-19(27(24)34)26(33)16-5-7-18(29)8-6-16/h2-10,13,20,31,34H,11-12,14H2,1H3InChIKey
VDXFFLRIVBIYSX-UHFFFAOYSA-NSynonyms
122170221
InChI=1SC28H22ClNO6c13623(32)1420(21131742315111230(25(15)17)28(21)35)2422(31)10919(27(24)34)26(33)165718(29)8616h21013203134H111214H21H3
methyl3(3((4chlorophenyl)carbonyl)26dihydroxyphenyl)3(4oxo12dihydro4Hpyrrolo(321ij)quinolin5yl)propanoate
methyl3(3(4chlorobenzoyl)26dihydroxyphenyl)3(11oxo1azatricyclo(6310^(412))dodeca468(12)9tetraen10yl)propanoate
methyl3(3(4chlorobenzoyl)26dihydroxyphenyl)3(4oxo24dihydro1Hpyrrolo(321ij)quinolin5yl)propanoate
MFCD31756786
ZINC000409415640
ZINC000409415641
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