(Q105341008)

English

methyl 2-[(2R,8aR)-8a-hydroperoxy-4a-methyl-8-methylidene-hexahydro-1H-naphthalen-2-yl]prop-2-enoate

group of stereoisomers with the chemical formula C₁₆H₂₄O₄

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Statements

group of stereoisomers

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eudesmane sesquiterpenoid

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eudesmane sesquiterpenoid

280.167459248 dalton

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based on heuristic

inferred from isomeric SMILES

chemical formula

C₁₆H₂₄O₄

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canonical SMILES

O=C(OC)C(=C)C1CCC2(C)CCCC(=C)C2(OO)C1

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isomeric SMILES

C=C(C(=O)OC)[C@@H]1CCC2(C)CCCC(=C)[C@]2(OO)C1

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Identifiers

InChI=1S/C16H24O4/c1-11-6-5-8-15(3)9-7-13(10-16(11,15)20-18)12(2)14(17)19-4/h13,18H,1-2,5-10H2,3-4H3/t13-,15?,16-/m1/s1

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XSFRJTINOXLAHU-YAELJHOLSA-N

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1 reference

based on heuristic

inferred from InChIKey

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