(Q105314211)

English

[(1R,2R,4R,6R,8S,9Z,11S)-8-hydroxy-4,9-dimethyl-14-methylidene-13-oxo-5,12-dioxatricyclo[9.3.0.04,6]tetradec-9-en-2-yl] furan-3-carboxylate

chemical compound

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Statements

instance of

type of chemical entity

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subclass of

(8-Hydroxy-4,9-dimethyl-14-methylidene-13-oxo-5,12-dioxatricyclo[9.3.0.04,6]tetradec-9-en-2-yl) furan-3-carboxylate

1 reference

based on heuristic

inferred from SMILES

mass

374.136553044 dalton

1 reference

based on heuristic

inferred from SMILES

chemical formula

C₂₀H₂₂O₇

0 references

canonical SMILES

O=C(OC1CC2(OC2CC(O)C(=CC3OC(=O)C(=C)C31)C)C)C4=COC=C4

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isomeric SMILES

C=C1C(=O)O[C@H]2/C=C(/C)[C@@H](O)C[C@H]3O[C@]3(C)C[C@@H](OC(=O)c3ccoc3)[C@@H]12

0 references

found in taxon

Schkuhria pinnata

1 reference

stated in

Sesquiterpene lactones from Schkuhria pinnata

Identifiers

InChI

InChI=1S/C20H22O7/c1-10-6-14-17(11(2)18(22)25-14)15(26-19(23)12-4-5-24-9-12)8-20(3)16(27-20)7-13(10)21/h4-6,9,13-17,21H,2,7-8H2,1,3H3/b10-6-/t13-,14-,15+,16+,17-,20+/m0/s1

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InChIKey

WWQBWBDEAHIHFL-HVVUWRDWSA-N

0 references

2 references

17 September 2022

inferred from InChIKey

matched by identifier from

InChIKey

WWQBWBDEAHIHFL-HVVUWRDWSA-N

(Q105314211)

[(1R,2R,4R,6R,8S,9Z,11S)-8-hydroxy-4,9-dimethyl-14-methylidene-13-oxo-5,12-dioxatricyclo[9.3.0.04,6]tetradec-9-en-2-yl] furan-3-carboxylate

Statements

Identifiers

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