Vitas-M small molecule compound
4-{[3-(4,8,8-trimethyl-2-oxo-7,8-dihydro-2H,6H-pyrano[3,2-g]chromen-3-yl)propanoyl]amino}butanoic acid
Catalog ID
STL518630
SMILES O=C(NCCCC(=O)O)CCc1c(=O)oc2c(c1C)cc1c(c2)OC(CC1)(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 C22H27NO6 MW 401.46 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H27NO6/c1-13-15(6-7-19(24)23-10-4-5-20(25)26)21(27)28-18-12-17-14(11-16(13)18)8-9-22(2,3)29-17/h11-12H,4-10H2,1-3H3,(H,23,24)(H,25,26)InChIKey
UBAKLUWDBBFINB-UHFFFAOYSA-NSynonyms
1014061-56-31014061563
17571950
4((3(488trimethyl2oxo78dihydro2H6Hpyrano(32g)chromen3yl)propanoyl)amino)butanoicacid
4(3(226trimethyl8oxo34dihydropyrano(32g)chromen7yl)propanoylamino)butanoicacid
4(3(488trimethyl2oxo2678tetrahydropyrano(32g)chromen3yl)propanamido)butanoicacid
InChI=1SC22H27NO6c11315(6719(24)23104520(25)26)21(27)2818121714(1116(13)18)8922(23)2917h1112H410H213H3(H2324)(H2526)
MFCD09843612
ZINC000012900505
ZINC12900505
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