Vitas-M small molecule compound
N-{[(8,8-dimethyl-2-oxo-4-propyl-9,10-dihydro-2H,8H-pyrano[2,3-f]chromen-5-yl)oxy]acetyl}-beta-alanine
Catalog ID
STL463457
SMILES CCCc1cc(=O)oc2c1c(OCC(=O)NCCC(=O)O)cc1c2CCC(O1)(C)C
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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 C22H27NO7 MW 417.46 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H27NO7/c1-4-5-13-10-19(27)29-21-14-6-8-22(2,3)30-15(14)11-16(20(13)21)28-12-17(24)23-9-7-18(25)26/h10-11H,4-9,12H2,1-3H3,(H,23,24)(H,25,26)InChIKey
PIMSAVYPZIAKSA-UHFFFAOYSA-NSynonyms
956608-05-23((2((88DIMETHYL2OXO4PROPYL910DIHYDROPYRANO(23H)CHROMEN5YL)OXY)ACETYL)AMINO)PROPANOICACID
3(2((88dimethyl2oxo4propyl28910tetrahydropyrano(23f)chromen5yl)oxy)acetamido)propanoicacid
956608052
CCCC1=CC(=O)OC2=C3CCC(OC3=CC(=C12)OCC(=O)NCCC(=O)O)(C)C
InChI=1SC22H27NO7c145131019(27)2921146822(23)3015(14)1116(20(13)21)281217(24)239718(25)26h1011H4912H213H3(H2324)(H2526)
MFCD08283088
N(((88dimethyl2oxo4propyl910dihydro2H8Hpyrano(23f)chromen5yl)oxy)acetyl)betaalanine
ZINC000006623954
ZINC6623954
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