(Q105179074)

English

(3R,3aS,5aR,9R,9aS,9bS)-9-hydroxy-3,5a,9-trimethyl-3,3a,4,5,9a,9b-hexahydrobenzo[g][1]benzofuran-2,6-dione

chemical compound

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instance of

type of chemical entity

0 references

1 reference

1 reference

264.13615912 dalton

1 reference

based on heuristic

inferred from SMILES

stereoisomer of

(3S,3aR,5aR,9S,9aS,9bS)-9-hydroxy-3,5a,9-trimethyl-3,3a,4,5,9a,9b-hexahydrobenzo[g][1]benzofuran-2,6-dione

1 reference

based on heuristic

inferred from InChI

(3S,3aR,5aR,9R,9aS,9bS)-9-hydroxy-3,5a,9-trimethyl-3,3a,4,5,9a,9b-hexahydrobenzo[g][1]benzofuran-2,6-dione

1 reference

1 reference

(3S)-3abeta,5,5a,9,9abeta,9balpha-Hexahydro-3beta,5aalpha,9-trimethyl-9alpha-hydroxynaphtho[1,2-b]furan-2,6(3H,4H)-dione

1 reference

1 reference

C₁₅H₂₀O₄

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canonical SMILES

O=C1OC2C(CCC3(C(=O)C=CC(O)(C)C23)C)C1C

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isomeric SMILES

C[C@H]1C(=O)O[C@H]2[C@H]1CC[C@@]1(C)C(=O)C=C[C@@](C)(O)[C@H]21

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found in taxon

Artemisia ludoviciana

1 reference

stated in

11,13-Dehydrodesacetylmatricarin and other sesquiterpene lactones from Artemisia ludoviciana var. Ludoviciana and the identity of artecanin and chyrsartemin B

Identifiers

InChI

InChI=1S/C15H20O4/c1-8-9-4-6-14(2)10(16)5-7-15(3,18)12(14)11(9)19-13(8)17/h5,7-9,11-12,18H,4,6H2,1-3H3/t8-,9+,11+,12-,14+,15-/m1/s1

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InChIKey

NGPDZEACIWDCKX-HWFUVBANSA-N

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2 references

17 September 2022

inferred from InChIKey

matched by identifier from

InChIKey

NGPDZEACIWDCKX-HWFUVBANSA-N

1 reference

(Q105179074)

(3R,3aS,5aR,9R,9aS,9bS)-9-hydroxy-3,5a,9-trimethyl-3,3a,4,5,9a,9b-hexahydrobenzo[g][1]benzofuran-2,6-dione

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Identifiers

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