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(Q83104661)
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14-Deoxylactucin
chemical compound
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Statements
instance of
type of chemical entity
0 references
subclass of
4-hydroxy-6,9-dimethyl-3-methylidene-3aH,4H,5H,9aH,9bH-azuleno[4,5-b]furan-2,7-dione
1 reference
based on heuristic
inferred from SMILES
mass
260.104858992
dalton
1 reference
based on heuristic
inferred from SMILES
stereoisomer of
(3aS,4S,9aS,9bR)-4-hydroxy-6,9-dimethyl-3-methylidene-4,5,9a,9b-tetrahydro-3aH-azuleno[4,5-b]furan-2,7-dione
2 references
based on heuristic
inferred from InChIKey
based on heuristic
inferred from InChI
(3aR,4S,9aR,9bR)-4-hydroxy-6,9-dimethyl-3-methylidene-4,5,9a,9b-tetrahydro-3aH-azuleno[4,5-b]furan-2,7-dione
2 references
based on heuristic
inferred from InChIKey
based on heuristic
inferred from InChI
(3aR,4S,9aR,9bS)-4-hydroxy-6,9-dimethyl-3-methylidene-4,5,9a,9b-tetrahydro-3aH-azuleno[4,5-b]furan-2,7-dione
1 reference
based on heuristic
inferred from InChI
chemical formula
C₁₅H₁₆O₄
0 references
canonical SMILES
O=C1OC2C3C(C(=O)C=C3C)=C(C)CC(O)C2C1=C
0 references
isomeric SMILES
C=C1C(=O)O[C@@H]2[C@H]3C(C)=CC(=O)C3=C(C)C[C@H](O)[C@@H]12
0 references
found in taxon
Achillea collina
2 references
stated in
Chemotypes in Achillea collina based on sesquiterpene lactone profile
stated in
Chemotypes in Achillea collina based on sesquiterpene lactone profile
Tanacetum cilicicum
1 reference
stated in
Sesquiterpenoids and other constituents from Tanacetum cilicium
Ajania fruticulosa
1 reference
stated in
Antifungal highly oxygenated guaianolides and other constituents from Ajania fruticulosa
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
Artemisia xerophytica
1 reference
stated in
Sesquiterpene lactones and other constituents from Artemisia xerophytica
Tanacetum cilicium
1 reference
stated in
Sesquiterpenoids and other constituents from Tanacetum cilicium
Identifiers
InChI
InChI=1S/C15H16O4/c1-6-4-10(17)13-8(3)15(18)19-14(13)12-7(2)5-9(16)11(6)12/h5,10,12-14,17H,3-4H2,1-2H3/t10-,12-,13+,14+/m0/s1
0 references
InChIKey
LLUKLZVIROBDGI-SCUASFONSA-N
0 references
CAS Registry Number
74635-52-2
0 references
PubChem CID
156302
1 reference
stated in
PubChem
retrieved
17 September 2022
based on heuristic
inferred from InChIKey
UniChem compound ID
32030501
1 reference
stated in
UniChem
DSSTox substance ID
DTXSID20225617
1 reference
matched by identifier from
InChIKey
InChIKey
LLUKLZVIROBDGI-SCUASFONSA-N
DSSTOX compound identifier
DTXCID50148108
0 references
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