Vitas-M small molecule compound

2-({[3-(4-bromophenyl)-5-methyl-7-oxo-7H-furo[3,2-g]chromen-6-yl]acetyl}amino)butanoic acid

Catalog ID
STL464037
SMILES CCC(C(=O)O)NC(=O)Cc1c(=O)oc2c(c1C)cc1c(c2)occ1c1ccc(cc1)Br

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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 C24H20BrNO6 MW 498.33 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H20BrNO6/c1-3-19(23(28)29)26-22(27)9-16-12(2)15-8-17-18(13-4-6-14(25)7-5-13)11-31-20(17)10-21(15)32-24(16)30/h4-8,10-11,19H,3,9H2,1-2H3,(H,26,27)(H,28,29)
InChIKey
PGHHRZUDMKIHKE-UHFFFAOYSA-N
Synonyms
1025067-48-4
1025067484
2(((3(4bromophenyl)5methyl7oxo7Hfuro(32g)chromen6yl)acetyl)amino)butanoicacid
2((2(3(4BROMOPHENYL)5METHYL7OXOFURO(32G)CHROMEN6YL)ACETYL)AMINO)BUTANOICACID
2(2(3(4bromophenyl)5methyl7oxo7Hfuro(32g)chromen6yl)acetamido)butanoicacid
CCC(C(=O)O)NC(=O)CC1=C(C2=C(C=C3C(=C2)C(=CO3)C4=CC=C(C=C4)Br)OC1=O)C
InChI=1SC24H20BrNO6c1319(23(28)29)2622(27)91612(2)1581718(134614(25)7513)113120(17)1021(15)3224(16)30h48101119H39H212H3(H2627)(H2829)
MFCD06494567
ZINC000002131570
ZINC000002131572

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Available files

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