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(Q104969415)
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English
(4R)-4-[(2S)-2-isocyano-6-methylhept-5-en-2-yl]-1-methylcyclohexene
chemical compound
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Statements
instance of
type of chemical entity
0 references
subclass of
bisabolanes
0 references
mass
231.1986998
dalton
1 reference
based on heuristic
inferred from SMILES
chemical formula
C₁₆H₂₅N
0 references
canonical SMILES
[C-]#[N+]C(C)(CCC=C(C)C)C1CC=C(C)CC1
0 references
isomeric SMILES
[C-]#[N+][C@@](C)(CCC=C(C)C)[C@H]1CC=C(C)CC1
0 references
found in taxon
Acanthella cavernosa
1 reference
stated in
A comparison of sesquiterpene scaffolds across different populations of the tropical marine sponge Acanthella cavernosa.
Identifiers
InChI
InChI=1S/C16H25N/c1-13(2)7-6-12-16(4,17-5)15-10-8-14(3)9-11-15/h7-8,15H,6,9-12H2,1-4H3/t15-,16-/m0/s1
0 references
InChIKey
CSKXFQOQKCBFIG-HOTGVXAUSA-N
0 references
PubChem CID
24179110
2 references
stated in
PubChem
retrieved
17 September 2022
based on heuristic
inferred from InChIKey
matched by identifier from
InChIKey
InChIKey
CSKXFQOQKCBFIG-HOTGVXAUSA-N
UniChem compound ID
32327106
1 reference
stated in
UniChem
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