(Q105130241)

English

alpha-Methylene-gamma-lactone, 3

group of stereoisomers with the chemical formula C₁₇H₂₄O₅

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Statements

group of stereoisomers

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xanthane sesquiterpenoid

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xanthane sesquiterpenoid

308.162373868 dalton

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based on heuristic

inferred from SMILES

chemical formula

C₁₇H₂₄O₅

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canonical SMILES

O=C1OC2CC(C(=CCC2C1=C)C(OC(=O)C)CC(O)C)C

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isomeric SMILES

C=C1C(=O)O[C@H]2C[C@H](C)C(C(CC(C)O)OC(C)=O)=CC[C@H]12

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Xanthium spinosum

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Xanthanolides from Xanthium spinosum

Identifiers

InChI=1S/C17H24O5/c1-9-7-15-14(11(3)17(20)22-15)6-5-13(9)16(8-10(2)18)21-12(4)19/h5,9-10,14-16,18H,3,6-8H2,1-2,4H3/t9-,10?,14+,15-,16?/m0/s1

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JKIKMDJRHDXNEW-UDDXETKPSA-N

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1 reference

17 September 2022

based on heuristic

inferred from InChIKey

UniChem compound ID

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