(Q105349006)

English

(1R,2S,4S,6R,9Z,11R)-2-hydroxy-9-(hydroxymethyl)-4-methyl-14-methylidene-5,12-dioxatricyclo[9.3.0.04,6]tetradec-9-en-13-one

chemical compound

In more languages

Statements

type of chemical entity

0 references

2-Hydroxy-9-(hydroxymethyl)-4-methyl-14-methylidene-5,12-dioxatricyclo[9.3.0.04,6]tetradec-9-en-13-one

1 reference

based on heuristic

inferred from SMILES

280.13107374 dalton

1 reference

based on heuristic

inferred from SMILES

chemical formula

C₁₅H₂₀O₅

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canonical SMILES

O=C1OC2C=C(CO)CCC3OC3(C)CC(O)C2C1=C

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isomeric SMILES

C=C1C(=O)O[C@@H]2/C=C(\CO)CC[C@H]3O[C@@]3(C)C[C@H](O)[C@@H]12

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Centaurea sphaerocephala

1 reference

Sesquiterpene lactones from Centaurea sphaerocephala ssp. sphaerocephala

Identifiers

InChI=1S/C15H20O5/c1-8-13-10(17)6-15(2)12(20-15)4-3-9(7-16)5-11(13)19-14(8)18/h5,10-13,16-17H,1,3-4,6-7H2,2H3/b9-5-/t10-,11+,12+,13+,15-/m0/s1

0 references

YIRQAQBMBKUQDI-JGGVDJITSA-N

0 references

1 reference

17 September 2022

based on heuristic

inferred from InChIKey

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