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(Q105289680)
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English
(3aR,6abeta,9abeta,9balpha)-Decahydro-3,6,9-tris(methylene)-4beta-hydroxyazuleno[4,5-b]furan-2(3H)-one
chemical compound
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Statements
instance of
type of chemical entity
0 references
subclass of
4-hydroxy-3,6,9-trimethylidene-octahydroazuleno[4,5-b]furan-2-one
1 reference
based on heuristic
inferred from SMILES
mass
246.125594436
dalton
1 reference
based on heuristic
inferred from SMILES
chemical formula
C₁₅H₁₈O₃
0 references
canonical SMILES
O=C1OC2C(C1=C)C(O)CC(=C)C3CCC(=C)C23
0 references
isomeric SMILES
C=C1C[C@H](O)[C@H]2C(=C)C(=O)O[C@@H]2[C@H]2C(=C)CC[C@@H]12
0 references
found in taxon
Cheirolophus canariensis
1 reference
stated in
Guaianolides from Centaurea canariensis
Centaurea triumfettii
1 reference
stated in
Guaianolides from Centaurea canariensis
Centaurea axillaris
1 reference
stated in
Guaianolides from Centaurea canariensis
Cheirolophus falcisectus
1 reference
stated in
Guaianolides from Centaurea canariensis
Cheirolophus sempervirens
1 reference
stated in
Sesquiterpene lactones, lignans and aromatic esters from Cheirolophus species
Identifiers
InChI
InChI=1S/C15H18O3/c1-7-4-5-10-8(2)6-11(16)13-9(3)15(17)18-14(13)12(7)10/h10-14,16H,1-6H2/t10-,11-,12-,13+,14+/m0/s1
0 references
InChIKey
VNKCRRIDZAQRBP-QSLWVIQJSA-N
0 references
PubChem CID
101675253
2 references
stated in
PubChem
retrieved
17 September 2022
based on heuristic
inferred from InChIKey
matched by identifier from
InChIKey
InChIKey
VNKCRRIDZAQRBP-QSLWVIQJSA-N
UniChem compound ID
97619607
1 reference
stated in
UniChem
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