(Q105015217)

English

(3S,3aS,5aR,9R,9aS,9bS)-9-hydroperoxy-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

subclass of

9-hydroperoxy-3,5a,9-trimethyl-3H,3aH,4H,5H,9aH,9bH-naphtho[1,2-b]furan-2,6-dione

1 reference

based on heuristic

inferred from SMILES

mass

280.13107374 dalton

1 reference

based on heuristic

inferred from SMILES

stereoisomer of

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

2 references

based on heuristic

inferred from InChIKey

based on heuristic

inferred from InChI

(3S,3aS,5aR,9S,9aS,9bS)-9-hydroperoxy-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

chemical formula

C₁₅H₂₀O₅

0 references

canonical SMILES

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

0 references

isomeric SMILES

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

0 references

found in taxon

Artemisia abyssinica

1 reference

stated in

Epi-Deoxyarteannuin B and 6,7-Dehydroartemisinic Acid from Artemisia annua

Identifiers

InChI

InChI=1S/C15H20O5/c1-8-9-4-6-14(2)10(16)5-7-15(3,20-18)12(14)11(9)19-13(8)17/h5,7-9,11-12,18H,4,6H2,1-3H3/t8-,9-,11-,12+,14-,15+/m0/s1

0 references

InChIKey

GPWOVUKAMABICF-WUDKWMPASA-N

0 references

2 references

17 September 2022

inferred from InChIKey

matched by identifier from

InChIKey

GPWOVUKAMABICF-WUDKWMPASA-N

(Q105015217)

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

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