Vitas-M small molecule compound
4-(2-amino-3-cyano-5-oxo-4H,5H-pyrano[3,2-c]chromen-4-yl)benzoic acid
Catalog ID
STK335667
SMILES N#CC1=C(N)Oc2c(C1c1ccc(cc1)C(=O)O)c(=O)oc1c2cccc1
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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 C20H12N2O5 MW 360.33 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H12N2O5/c21-9-13-15(10-5-7-11(8-6-10)19(23)24)16-17(27-18(13)22)12-3-1-2-4-14(12)26-20(16)25/h1-8,15H,22H2,(H,23,24)InChIKey
QTGHPOZDYAZAMH-UHFFFAOYSA-NSynonyms
4(2amino3cyano5oxo4H5Hpyrano(32c)chromen4yl)benzoicacid
4(2amino3cyano5oxo4Hpyrano(32c)chromen4yl)benzoicacid
C1=CC=C2C(=C1)C3=C(C(C(=C(O3)N)C#N)C4=CC=C(C=C4)C(=O)O)C(=O)O2
InChI=1SC20H12N2O5c2191315(105711(8610)19(23)24)1617(2718(13)22)12312414(12)2620(16)25h1815H22H2(H2324)
MFCD09964158
ZINC000018199669
ZINC000018199671
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