(Q110194109)

English

(1aR,4aR,5aR,8aR,9aS)-1a,4a-dimethyl-8-methylideneoctahydro-1aH-oxireno[4a,5]naphtho[2,3-b]furan-7(8H)-one

chemical compound

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Statements

instance of

type of chemical entity

0 references

subclass of

eudesmane sesquiterpenoid

1 reference

based on heuristic

inferred from SMILES

mass

248.1412445 dalton

1 reference

based on heuristic

inferred from SMILES

stereoisomer of

(1R,3R,7R,9R,13S)-9,13-dimethyl-4-methylidene-6,14-dioxatetracyclo[7.5.0.01,13.03,7]tetradecan-5-one

1 reference

based on heuristic

inferred from InChI

chemical formula

C₁₅H₂₀O₃

0 references

canonical SMILES

O=C1OC2CC3(C)CCCC4(OC43CC2C1=C)C

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isomeric SMILES

C=C1C(=O)O[C@@H]2C[C@@]3(C)CCC[C@@]4(C)O[C@@]34C[C@H]12

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found in taxon

Inula helenium

1 reference

stated in

Sesquiterpenoids, alantolactone analogues, and seco-guaiene from the roots of Inula helenium

Identifiers

InChI

InChI=1S/C15H20O3/c1-9-10-7-15-13(2,8-11(10)17-12(9)16)5-4-6-14(15,3)18-15/h10-11H,1,4-8H2,2-3H3/t10-,11-,13-,14-,15+/m1/s1

0 references

InChIKey

BSZNUAGWEMADPW-BBIZWXPBSA-N

0 references

2 references

17 September 2022

inferred from InChIKey

matched by identifier from

InChIKey

BSZNUAGWEMADPW-BBIZWXPBSA-N

1 reference

(Q110194109)

(1aR,4aR,5aR,8aR,9aS)-1a,4a-dimethyl-8-methylideneoctahydro-1aH-oxireno[4a,5]naphtho[2,3-b]furan-7(8H)-one

Statements

Identifiers

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