Vitas-M small molecule compound

methyl 3-[7-hydroxy-3-(4-hydroxyphenyl)-4-oxo-4H-chromen-8-yl]-3-(5-oxo-2,3-dihydro-1H,5H-pyrido[3,2,1-ij]quinolin-6-yl)propanoate

Catalog ID
STL540616
SMILES COC(=O)CC(c1cc2cccc3c2n(c1=O)CCC3)c1c(O)ccc2c1occ(c2=O)c1ccc(cc1)O

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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 C31H25NO7 MW 523.54 g/mol Purity >90% as per NMR
InChI
InChI=1S/C31H25NO7/c1-38-26(35)15-22(23-14-19-5-2-4-18-6-3-13-32(28(18)19)31(23)37)27-25(34)12-11-21-29(36)24(16-39-30(21)27)17-7-9-20(33)10-8-17/h2,4-5,7-12,14,16,22,33-34H,3,6,13,15H2,1H3
InChIKey
KSWCBOFSTRPINJ-UHFFFAOYSA-N
Synonyms
1574320-63-0
1574320630
71825769
InChI=1SC31H25NO7c13826(35)1522(23141952418631332(28(18)19)31(23)37)2725(34)12112129(36)24(163930(21)27)177920(33)10817h2457121416223334H361315H21H3
methyl3(7hydroxy3(4hydroxyphenyl)4oxo4Hchromen8yl)3(3oxo3567tetrahydropyrido(321ij)quinolin2yl)propanoate
methyl3(7hydroxy3(4hydroxyphenyl)4oxo4Hchromen8yl)3(5oxo23dihydro1H5Hpyrido(321ij)quinolin6yl)propanoate
methyl3(7hydroxy3(4hydroxyphenyl)4oxochromen8yl)3(2oxo1azatricyclo(7310^(513))trideca35(13)68tetraen3yl)propanoate
MFCD28051901
ZINC000096116180
ZINC000096116181

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Available files

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