Vitas-M small molecule compound
6-chloro-7-{[(2E)-3,7-dimethylocta-2,6-dien-1-yl]oxy}-4-phenyl-2H-chromen-2-one
Catalog ID
STK716667
SMILES C/C(=C\COc1cc2oc(=O)cc(c2cc1Cl)c1ccccc1)/CCC=C(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 C25H25ClO3 MW 408.92 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H25ClO3/c1-17(2)8-7-9-18(3)12-13-28-24-16-23-21(14-22(24)26)20(15-25(27)29-23)19-10-5-4-6-11-19/h4-6,8,10-12,14-16H,7,9,13H2,1-3H3/b18-12+InChIKey
FITWQBRIABOSIH-LDADJPATSA-NSynonyms
376380-21-1(E)6chloro7((37dimethylocta26dien1yl)oxy)4phenyl2Hchromen2one
376380211
6chloro7(((2E)37dimethylocta26dien1yl)oxy)4phenyl2Hchromen2one
6CHLORO7((2E)37DIMETHYLOCTA26DIENOXY)4PHENYLCHROMEN2ONE
CC(=CCCC(=CCOC1=C(C=C2C(=CC(=O)OC2=C1)C3=CC=CC=C3)Cl)C)C
CC(=CCOc1cc2oc(=O)cc(c2cc1Cl)c1ccccc1)CCC=C(C)C
InChI=1SC25H25ClO3c117(2)87918(3)12132824162321(1422(24)26)20(1525(27)2923)19105461119h46810121416H7913H213H3b1812+
MFCD02925511
ZINC000002440523
ZINC02440523
ZINC2440523
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