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(Q105199453)
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English
Santalone
group of stereoisomers with the chemical formula C₁₁H₁₆O
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Statements
instance of
group of stereoisomers
0 references
subclass of
chemical compound
0 references
mass
164.120115132
dalton
1 reference
based on heuristic
inferred from SMILES
chemical formula
C₁₁H₁₆O
0 references
canonical SMILES
O=C(C)C1(C)C2CC3C(C2)C31C
0 references
found in taxon
Santalum
1 reference
stated in
A Chemical Investigation of the Volatile Constituents of East Indian Sandalwood Oil (SantalumalbumL.)
Santalum album
1 reference
stated in
A Chemical Investigation of the Volatile Constituents of East Indian Sandalwood Oil (SantalumalbumL.)
Identifiers
InChI
InChI=1S/C11H16O/c1-6(12)10(2)7-4-8-9(5-7)11(8,10)3/h7-9H,4-5H2,1-3H3
0 references
InChIKey
OTAKYGLQNSNZRX-UHFFFAOYSA-N
0 references
CAS Registry Number
59300-51-5
1 reference
stated in
CAS (formerly Chemical Abstracts Service)
retrieved
25 January 2022
PubChem CID
71438766
2 references
stated in
PubChem
retrieved
26 December 2021
inferred from
InChIKey
matched by identifier from
InChIKey
InChIKey
OTAKYGLQNSNZRX-UHFFFAOYSA-N
ChEBI ID
195764
mapping relation type
exact match
1 reference
matched by identifier from
International Chemical Identifier
InChI
InChI=1S/C11H16O/c1-6(12)10(2)7-4-8-9(5-7)11(8,10)3/h7-9H,4-5H2,1-3H3
UniChem compound ID
32022449
1 reference
stated in
UniChem
DSSTox substance ID
DTXSID201318581
1 reference
matched by identifier from
InChIKey
InChIKey
OTAKYGLQNSNZRX-UHFFFAOYSA-N
Human Metabolome Database ID
HMDB0036814
2 references
based on heuristic
inferred from InChIKey
matched by identifier from
InChIKey
InChIKey
OTAKYGLQNSNZRX-UHFFFAOYSA-N
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