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(Q105025295)
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English
3,7,7-trimethyl-2-oxatricyclo[4.1.1.0¹,³]octane
group of stereoisomers with the chemical formula C₁₀H₁₆O
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Statements
instance of
group of stereoisomers
0 references
subclass of
pinane monoterpenoid
1 reference
inferred from
pinane monoterpenoid
mass
152.120115132
dalton
1 reference
based on heuristic
inferred from SMILES
chemical formula
C₁₀H₁₆O
0 references
canonical SMILES
O1C2(C)CCC3CC12C3(C)C
0 references
found in taxon
Angelica gigas
1 reference
stated in
Volatile organic compounds of Angelica gigas Nakai, Korean medicinal herb
Identifiers
InChI
InChI=1S/C10H16O/c1-8(2)7-4-5-9(3)10(8,6-7)11-9/h7H,4-6H2,1-3H3
0 references
InChIKey
HBHHPIRVIMLDJH-UHFFFAOYSA-N
0 references
CAS Registry Number
74525-43-2
1 reference
stated in
CAS (formerly Chemical Abstracts Service)
retrieved
25 January 2022
PubChem CID
87085732
1 reference
stated in
PubChem
retrieved
17 September 2022
based on heuristic
inferred from InChIKey
SureChEMBL ID
SCHEMBL260526
2 references
based on heuristic
inferred from InChIKey
matched by identifier from
InChIKey
InChIKey
HBHHPIRVIMLDJH-UHFFFAOYSA-N
UniChem compound ID
75265721
1 reference
stated in
UniChem
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