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(Q105007771)
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English
Rothin A
chemical compound
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Statements
instance of
type of chemical entity
0 references
subclass of
eudesmane sesquiterpenoid
0 references
mass
248.1412445
dalton
1 reference
based on heuristic
inferred from SMILES
chemical formula
C₁₅H₂₀O₃
0 references
canonical SMILES
O=C1OC2C3=C(C)CCCC3(C)CC(O)C2C1=C
0 references
isomeric SMILES
C=C1C(=O)O[C@@H]2C3=C(C)CCC[C@]3(C)C[C@H](O)[C@@H]12
0 references
found in taxon
Artemisia rothrockii
1 reference
stated in
Sesquiterpene lactones from Artemisia: Arbusculin-C, rothin-A and rothin-B
Identifiers
InChI
InChI=1S/C15H20O3/c1-8-5-4-6-15(3)7-10(16)11-9(2)14(17)18-13(11)12(8)15/h10-11,13,16H,2,4-7H2,1,3H3/t10-,11+,13-,15+/m0/s1
0 references
InChIKey
GFTABBWAVCHCRO-YODMDTAWSA-N
0 references
PubChem CID
26088012
2 references
stated in
PubChem
retrieved
17 September 2022
based on heuristic
inferred from InChIKey
matched by identifier from
InChIKey
InChIKey
GFTABBWAVCHCRO-YODMDTAWSA-N
UniChem compound ID
97243514
1 reference
stated in
UniChem
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