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(Q105207779)
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English
CID 101289704
chemical compound
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Statements
instance of
type of chemical entity
0 references
subclass of
Curcolone
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=C1C2=C(OC=C2C)CC3(C1=C(C)CCC3O)C
0 references
isomeric SMILES
CC1=C2C(=O)c3c(C)coc3C[C@]2(C)[C@@H](O)CC1
0 references
found in taxon
Curcuma zedoaria
1 reference
stated in
Medicinal foodstuffs. XXVIII. Inhibitors of nitric oxide production and new sesquiterpenes, zedoarofuran, 4-epicurcumenol, neocurcumenol, gajutsulactones A and B, and zedoarolides A and B, from Zedoariae Rhizoma
Identifiers
InChI
InChI=1S/C15H18O3/c1-8-4-5-11(16)15(3)6-10-12(9(2)7-18-10)14(17)13(8)15/h7,11,16H,4-6H2,1-3H3/t11-,15+/m0/s1
0 references
InChIKey
PFIXJSCFTAVWBW-XHDPSFHLSA-N
0 references
CAS Registry Number
17015-43-9
1 reference
stated in
CAS (formerly Chemical Abstracts Service)
retrieved
25 January 2022
PubChem CID
101289704
2 references
stated in
PubChem
retrieved
17 September 2022
based on heuristic
inferred from InChIKey
matched by identifier from
InChIKey
InChIKey
PFIXJSCFTAVWBW-XHDPSFHLSA-N
UniChem compound ID
97484791
1 reference
stated in
UniChem
DSSTox substance ID
DTXSID901318601
1 reference
matched by identifier from
InChIKey
InChIKey
PFIXJSCFTAVWBW-XHDPSFHLSA-N
UNII
V7952LU6NQ
1 reference
matched by identifier from
InChIKey
InChIKey
PFIXJSCFTAVWBW-XHDPSFHLSA-N
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