(Q105188495)

English

[(1S,2S,5S,6R,7S,10R,12R,14S)-5,14-dimethyl-9-methylidene-4-oxo-3,13-dioxatetracyclo[8.4.0.02,6.012,14]tetradecan-7-yl] (E)-2-methylbut-2-enoate

chemical compound

In more languages

Statements

type of chemical entity

0 references

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

1 reference

based on heuristic

inferred from SMILES

346.178023932 dalton

1 reference

based on heuristic

inferred from SMILES

chemical formula

C₂₀H₂₆O₅

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canonical SMILES

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

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isomeric SMILES

C=C1C[C@H](OC(=O)/C(C)=C/C)[C@H]2[C@H](C)C(=O)O[C@@H]2[C@@H]2[C@H]1C[C@H]1O[C@@]21C

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Artemisia douglasiana

1 reference

11β,13-Dihydroguaianolides from Artemisia douglasiana and a thiophene acetylene from A. schmidtiana

Identifiers

InChI=1S/C20H26O5/c1-6-9(2)18(21)23-13-7-10(3)12-8-14-20(5,25-14)16(12)17-15(13)11(4)19(22)24-17/h6,11-17H,3,7-8H2,1-2,4-5H3/b9-6+/t11-,12-,13-,14+,15+,16-,17-,20+/m0/s1

0 references

NZWKINCEHBYGFE-AZVUSUNZSA-N

0 references

1 reference

17 September 2022

based on heuristic

inferred from InChIKey

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