(Q105382570)

English

8-[2-(2-methoxy-5-oxo-2H-furan-4-yl)ethyl]-4,7,8-trimethyl-1,2,5,6,7,8a-hexahydronaphthalene-4a-carboxylic acid

group of stereoisomers with the chemical formula C₂₁H₃₀O₅

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Statements

group of stereoisomers

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clerodane diterpenoid

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clerodane diterpenoid

362.20932405999986 dalton

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based on heuristic

inferred from InChI

chemical formula

C₂₁H₃₀O₅

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canonical SMILES

O=C1OC(OC)C=C1CCC2(C)C(C)CCC3(C(=O)O)C(=CCCC32)C

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Identifiers

InChI=1S/C21H30O5/c1-13-8-11-21(19(23)24)14(2)6-5-7-16(21)20(13,3)10-9-15-12-17(25-4)26-18(15)22/h6,12-13,16-17H,5,7-11H2,1-4H3,(H,23,24)

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ZSKQNYQQCWYYSU-UHFFFAOYSA-N

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2 references

based on heuristic

inferred from InChIKey

matched by identifier from

ZSKQNYQQCWYYSU-UHFFFAOYSA-N

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