(Q105311510)

English

(9-Hydroxy-9,14-dimethyl-5-methylidene-4-oxo-3,13-dioxatetracyclo[8.4.0.02,6.012,14]tetradecan-7-yl) 2-methylbut-2-enoate

group of stereoisomers with the chemical formula C₂₀H₂₆O₆

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instance of

group of stereoisomers

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subclass of

guaiane sesquiterpenoid

1 reference

inferred from

guaiane sesquiterpenoid

mass

362.172938552 dalton

1 reference

based on heuristic

inferred from SMILES

chemical formula

C₂₀H₂₆O₆

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canonical SMILES

O=C(OC1CC(O)(C)C2CC3OC3(C)C2C4OC(=O)C(=C)C14)C(=CC)C

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Identifiers

InChI

InChI=1S/C20H26O6/c1-6-9(2)17(21)24-12-8-19(4,23)11-7-13-20(5,26-13)15(11)16-14(12)10(3)18(22)25-16/h6,11-16,23H,3,7-8H2,1-2,4-5H3

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InChIKey

WRQBJIKCDFWQPS-UHFFFAOYSA-N

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2 references

17 September 2022

inferred from InChIKey

matched by identifier from

InChIKey

WRQBJIKCDFWQPS-UHFFFAOYSA-N

(Q105311510)

(9-Hydroxy-9,14-dimethyl-5-methylidene-4-oxo-3,13-dioxatetracyclo[8.4.0.02,6.012,14]tetradecan-7-yl) 2-methylbut-2-enoate

Statements

Identifiers

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