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(Q125029787)
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β-rotunol
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Statements
instance of
type of chemical entity
0 references
subclass of
cycloguaiane sesquiterpenoid
1 reference
based on heuristic
inferred from SMILES
mass
204.187800768
dalton
1 reference
based on heuristic
inferred from SMILES
stereoisomer of
(1R,4S,5S,7S)-4,10,11,11-tetramethyltricyclo[5.3.1.01,5]undec-9-ene
2 references
based on heuristic
inferred from InChIKey
based on heuristic
inferred from InChI
chemical formula
C₁₅H₂₄
0 references
canonical SMILES
C1=C(C)C23CCC(C)C3CC(C1)C2(C)C
0 references
isomeric SMILES
CC1=CC[C@H]2C[C@@H]3[C@H](C)CC[C@@]13C2(C)C
0 references
found in taxon
Achillea millefolium
1 reference
stated in
Volatile Constituents of Achillea millefolium L. ssp. millefolium from Iran
Identifiers
InChI
InChI=1S/C15H24/c1-10-7-8-15-11(2)5-6-12(9-13(10)15)14(15,3)4/h5,10,12-13H,6-9H2,1-4H3/t10-,12+,13-,15-/m1/s1
0 references
InChIKey
KVQOADNSNSUAJT-CQROYNQRSA-N
0 references
PubChem CID
22211718
2 references
stated in
PubChem
retrieved
26 April 2024
based on heuristic
inferred from InChIKey
matched by identifier from
InChIKey
InChIKey
KVQOADNSNSUAJT-CQROYNQRSA-N
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