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English
(2Z,6E)-hedycaryol
chemical compound
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Statements
instance of
type of chemical entity
0 references
subclass of
tertiary alcohol
0 references
mass
222.198365452
dalton
1 reference
based on heuristic
inferred from isomeric SMILES
stereoisomer of
(2E,6E)-hedycaryol
2 references
based on heuristic
inferred from InChIKey
based on heuristic
inferred from InChI
Hedycaryol
1 reference
based on heuristic
inferred from InChI
chemical formula
C₁₅H₂₆O
0 references
canonical SMILES
CC1=CCC(C(C)(C)O)CCC(C)=CCC1
1 reference
based on heuristic
inferred from isomeric SMILES
isomeric SMILES
C/C/1=C\CC/C(=C\C[C@@H](CC1)C(C)(C)O)/C
0 references
Identifiers
InChI
InChI=1S/C15H26O/c1-12-6-5-7-13(2)9-11-14(10-8-12)15(3,4)16/h6,9,14,16H,5,7-8,10-11H2,1-4H3/b12-6+,13-9-/t14-/m1/s1
0 references
InChIKey
SDMLCXJKAYFHQM-NCUXMUJLSA-N
2 references
stated in
ChEBI release 2019-11-01
stated in
ChEBI release 2020-09-01
PubChem CID
129626788
1 reference
matched by identifier from
InChIKey
InChIKey
SDMLCXJKAYFHQM-NCUXMUJLSA-N
ChEBI ID
138044
mapping relation type
exact match
1 reference
matched by identifier from
International Chemical Identifier
InChI
InChI=1S/C15H26O/c1-12-6-5-7-13(2)9-11-14(10-8-12)15(3,4)16/h6,9,14,16H,5,7-8,10-11H2,1-4H3/b12-6+,13-9-/t14-/m1/s1
UniChem compound ID
161385010
1 reference
stated in
UniChem
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