(Q105375691)

English

[4-(acetyloxymethyl)-1-(3-methylbut-2-enoyloxy)spiro[6,7a-dihydro-1H-cyclopenta[c]pyran-7,2'-oxirane]-6-yl] 3-methylbutanoate

group of stereoisomers with the chemical formula C₂₂H₂₈O₈

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Statements

instance of

group of stereoisomers

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1 reference

420.178417856 dalton

1 reference

based on heuristic

inferred from SMILES

chemical formula

C₂₂H₂₈O₈

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canonical SMILES

O=C(OC1OC=C(C2=CC(OC(=O)CC(C)C)C3(OC3)C21)COC(=O)C)C=C(C)C

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found in taxon

Valeriana officinalis

1 reference

stated in

The biological activity of Valerian and related plants

Identifiers

InChI

InChI=1S/C22H28O8/c1-12(2)6-18(24)29-17-8-16-15(9-26-14(5)23)10-27-21(20(16)22(17)11-28-22)30-19(25)7-13(3)4/h7-8,10,12,17,20-21H,6,9,11H2,1-5H3

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InChIKey

ZHFDCOHUCIESBS-UHFFFAOYSA-N

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2 references

17 September 2022

inferred from InChIKey

matched by identifier from

InChIKey

ZHFDCOHUCIESBS-UHFFFAOYSA-N

(Q105375691)

[4-(acetyloxymethyl)-1-(3-methylbut-2-enoyloxy)spiro[6,7a-dihydro-1H-cyclopenta[c]pyran-7,2'-oxirane]-6-yl] 3-methylbutanoate

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Identifiers

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