(Q105131158)

English

methyl (2S)-2-methyl-8-(3-methylbutyl)-2-(4-methylpentyl)-3,4-dihydrochromene-6-carboxylate

chemical compound

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Statements

type of chemical entity

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2,6-dimethyloctane monoterpenoid

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360.266445012 dalton

1 reference

based on heuristic

inferred from SMILES

chemical formula

C₂₃H₃₆O₃

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canonical SMILES

O=C(OC)C=1C=C(C=2OC(C)(CCC2C1)CCCC(C)C)CCC(C)C

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isomeric SMILES

COC(=O)c1cc(CCC(C)C)c2c(c1)CC[C@](C)(CCCC(C)C)O2

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1 reference

Natural chromenes and chromene derivatives as potential anti-trypanosomal agents

Identifiers

InChI=1S/C23H36O3/c1-16(2)8-7-12-23(5)13-11-19-15-20(22(24)25-6)14-18(21(19)26-23)10-9-17(3)4/h14-17H,7-13H2,1-6H3/t23-/m0/s1

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JLWGAJAFCQCLFY-QHCPKHFHSA-N

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1 reference

17 September 2022

based on heuristic

inferred from InChIKey

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