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(Q104399448)
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English
Dehydrobrachylaenolide
chemical compound
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No label defined
No description defined
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Statements
instance of
type of chemical entity
0 references
subclass of
5a-methyl-3,9-dimethylidene-3aH,4H,5H,9aH,9bH-naphtho[1,2-b]furan-2,8-dione
1 reference
based on heuristic
inferred from SMILES
mass
244.109944372
dalton
1 reference
based on heuristic
inferred from SMILES
chemical formula
C₁₅H₁₆O₃
0 references
canonical SMILES
O=C1OC2C(C1=C)CCC3(C=CC(=O)C(=C)C23)C
0 references
isomeric SMILES
C=C1C(=O)O[C@H]2[C@H]1CC[C@@]1(C)C=CC(=O)C(=C)[C@H]21
0 references
found in taxon
Hieracium intybaceum
1 reference
stated in
Eudesmane Derivatives fromHieracium intybaceum
Arctotis arctotoides
1 reference
stated in
Bioactive sesquiterpene lactones isolated from the shoots of Arctotis arctotoides
Arctotheca calendula
1 reference
stated in
Sesquiterpene lactones and farnesol derivatives from Arctotis and Aarctotheca species
Brachylaena discolor var. transvaalensis
1 reference
stated in
Sesquiterpene lactones from Brachylaena species
Identifiers
InChI
InChI=1S/C15H16O3/c1-8-10-4-6-15(3)7-5-11(16)9(2)12(15)13(10)18-14(8)17/h5,7,10,12-13H,1-2,4,6H2,3H3/t10-,12+,13-,15-/m0/s1
0 references
InChIKey
GYBDKJQMRUKMGE-QJZXMWHDSA-N
0 references
PubChem CID
404548
1 reference
stated in
PubChem
retrieved
17 September 2022
based on heuristic
inferred from InChIKey
UniChem compound ID
27263670
1 reference
stated in
UniChem
NMRShiftDB structure ID
20182415
1 reference
matched by identifier from
InChIKey
InChIKey
GYBDKJQMRUKMGE-QJZXMWHDSA-N
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