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(Q105328950)
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English
3,5a,9-Trimethyl-3a,5,5a,9b-tetrahydronaphtho[1,2-b]furan-2,8(3H,4H)-dione
group of stereoisomers with the chemical formula C₁₅H₁₈O₃
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Statements
instance of
group of stereoisomers
0 references
subclass of
eudesmane sesquiterpenoid
1 reference
inferred from
eudesmane sesquiterpenoid
mass
246.125594436
dalton
1 reference
based on heuristic
inferred from SMILES
chemical formula
C₁₅H₁₈O₃
0 references
canonical SMILES
O=C1C=CC2(C(=C1C)C3OC(=O)C(C)C3CC2)C
0 references
found in taxon
Artemisia michauxiana
1 reference
stated in
Lactones fromArtemisia tenuisecta
Artemisia tenuis
1 reference
stated in
Lactones fromArtemisia tenuisecta
Artemisia caerulescens
1 reference
stated in
Eudesman-12,8β-olides and other terpenes from Artemisia species
Identifiers
InChI
InChI=1S/C15H18O3/c1-8-10-4-6-15(3)7-5-11(16)9(2)12(15)13(10)18-14(8)17/h5,7-8,10,13H,4,6H2,1-3H3
0 references
InChIKey
XJHDMGJURBVLLE-UHFFFAOYSA-N
0 references
PubChem CID
5156
2 references
stated in
PubChem
retrieved
17 September 2022
based on heuristic
inferred from InChIKey
matched by identifier from
InChIKey
InChIKey
XJHDMGJURBVLLE-UHFFFAOYSA-N
ChEBI ID
181343
mapping relation type
exact match
2 references
stated in
ChEBI release 2022-06-13
matched by identifier from
International Chemical Identifier
InChI
InChI=1S/C15H18O3/c1-8-10-4-6-15(3)7-5-11(16)9(2)12(15)13(10)18-14(8)17/h5,7-8,10,13H,4,6H2,1-3H3
SureChEMBL ID
SCHEMBL707621
2 references
based on heuristic
inferred from InChIKey
matched by identifier from
InChIKey
InChIKey
XJHDMGJURBVLLE-UHFFFAOYSA-N
UniChem compound ID
219394
1 reference
stated in
UniChem
MassBank accession ID
MSBNK-Washington_State_Univ-BML82140
1 reference
stated in
MassBank/MassBank-data: release version 2022.06 to wikidata
retrieved
4 September 2022
InChIKey
XJHDMGJURBVLLE-UHFFFAOYSA-N
based on heuristic
InChIKey match
MSBNK-Washington_State_Univ-BML82141
1 reference
stated in
MassBank/MassBank-data: release version 2022.06 to wikidata
retrieved
4 September 2022
InChIKey
XJHDMGJURBVLLE-UHFFFAOYSA-N
based on heuristic
InChIKey match
MSBNK-Washington_State_Univ-BML82142
1 reference
stated in
MassBank/MassBank-data: release version 2022.06 to wikidata
retrieved
4 September 2022
InChIKey
XJHDMGJURBVLLE-UHFFFAOYSA-N
based on heuristic
InChIKey match
MSBNK-Washington_State_Univ-BML00473
1 reference
InChIKey
XJHDMGJURBVLLE-UHFFFAOYSA-N
stated in
MassBank/MassBank-data: release version 2022.06 to wikidata
retrieved
4 September 2022
based on heuristic
InChIKey match
MSBNK-Washington_State_Univ-BML00482
1 reference
InChIKey
XJHDMGJURBVLLE-UHFFFAOYSA-N
stated in
MassBank/MassBank-data: release version 2022.06 to wikidata
retrieved
4 September 2022
based on heuristic
InChIKey match
MSBNK-Washington_State_Univ-BML00491
1 reference
InChIKey
XJHDMGJURBVLLE-UHFFFAOYSA-N
stated in
MassBank/MassBank-data: release version 2022.06 to wikidata
retrieved
4 September 2022
based on heuristic
InChIKey match
Probes And Drugs ID
PD014682
0 references
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