Vitas-M small molecule compound
3-[3-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-5,9-dimethyl-7-oxo-7H-furo[3,2-g]chromen-6-yl]propanoic acid
Catalog ID
STL467889
SMILES OC(=O)CCc1c(=O)oc2c(c1C)cc1c(c2C)occ1c1ccc2c(c1)OCCCO2
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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 C25H22O7 MW 434.45 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H22O7/c1-13-16(5-7-22(26)27)25(28)32-24-14(2)23-18(11-17(13)24)19(12-31-23)15-4-6-20-21(10-15)30-9-3-8-29-20/h4,6,10-12H,3,5,7-9H2,1-2H3,(H,26,27)InChIKey
GVKPXLKKRLVABN-UHFFFAOYSA-NSynonyms
1190298-09-91190298099
3(3(34dihydro2H15benzodioxepin7yl)59dimethyl7oxo7Hfuro(32g)chromen6yl)propanoicacid
3(3(34dihydro2H15benzodioxepin7yl)59dimethyl7oxofuro(32g)chromen6yl)propanoicacid
3(3(34dihydro2Hbenzo(b)(14)dioxepin7yl)59dimethyl7oxo7Hfuro(32g)chromen6yl)propanoicacid
CC1=C(C(=O)OC2=C1C=C3C(=COC3=C2C)C4=CC5=C(C=C4)OCCCO5)CCC(=O)O
InChI=1SC25H22O7c11316(5722(26)27)25(28)322414(2)2318(1117(13)24)19(123123)15462021(1015)309382920h461012H3579H212H3(H2627)
MFCD13677054
ZINC000036370009
ZINC36370009
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