(Q105223410)

English

9abeta-Hydroxy-4a,5,6,7,8,8abeta,9,9a-octahydro-3,4abeta,5beta-trimethylnaphtho[2,3-b]furan-2(4H)-one

chemical compound

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Statements

instance of

type of chemical entity

0 references

subclass of

9a-hydroxy-3,4a,5-trimethyl-5,6,7,8,8a,9-hexahydro-4H-benzo[f][1]benzofuran-2-one

1 reference

based on heuristic

inferred from SMILES

mass

250.156894564 dalton

1 reference

based on heuristic

inferred from SMILES

stereoisomer of

9a-Hydroxy-3,4a,5-trimethyl-4a,5,6,7,8,8a,9,9a-octahydronaphtho[2,3-b]furan-2(4H)-one

2 references

based on heuristic

inferred from InChIKey

based on heuristic

inferred from InChI

chemical formula

C₁₅H₂₂O₃

0 references

canonical SMILES

O=C1OC2(O)C(=C1C)CC3(C)C(C)CCCC3C2

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isomeric SMILES

CC1=C2C[C@]3(C)[C@@H](C)CCC[C@@H]3C[C@]2(O)OC1=O

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found in taxon

Ligularia fischerii

1 reference

stated in

Eremophilenolides from Ligularia fischeri

Ligularia lamarum

1 reference

stated in

Overlapping chemical and genetic diversity in Ligularia lamarum and Ligularia subspicata. Isolation of ten new eremophilanes and a new seco-bakkane compound

Camptacra gracilis

1 reference

stated in

Overlapping chemical and genetic diversity in Ligularia lamarum and Ligularia subspicata. Isolation of ten new eremophilanes and a new seco-bakkane compound

Ligularia subspicata

1 reference

stated in

Overlapping chemical and genetic diversity in Ligularia lamarum and Ligularia subspicata. Isolation of ten new eremophilanes and a new seco-bakkane compound

Petasites hybridus

3 references

stated in

Differential and stereoselective in vitro cytotoxicity of eremophilane sesquiterpenes of Petasites hybridus rhizomes in rat hepatocytes.

stated in

New Eremophilane Sesquiterpenes from a Rhizome Extract ofPetasites hybridus

stated in

Absolute configuration of eremophilane sesquiterpenes from Petasites hybridus: comparison of experimental and calculated circular dichroism spectra.

Petasites tatewakianus

1 reference

stated in

Sesquiterpenoids from Petasites tatewakianus

Identifiers

InChI

InChI=1S/C15H22O3/c1-9-5-4-6-11-7-15(17)12(8-14(9,11)3)10(2)13(16)18-15/h9,11,17H,4-8H2,1-3H3/t9-,11+,14+,15-/m0/s1

0 references

InChIKey

QKYLNUXCPSRUNA-PVRXDPTQSA-N

0 references

1 reference

17 September 2022

inferred from InChIKey

1 reference

(Q105223410)

9abeta-Hydroxy-4a,5,6,7,8,8abeta,9,9a-octahydro-3,4abeta,5beta-trimethylnaphtho[2,3-b]furan-2(4H)-one

Statements

Identifiers

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