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(Q105252767)
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English
4-Isothiocyanato-8a-methyl-5-methylidene-3-prop-1-en-2-yl-1,2,3,4,4a,6,7,8-octahydronaphthalene
group of stereoisomers with the chemical formula C₁₆H₂₃NS
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Statements
instance of
group of stereoisomers
0 references
subclass of
eudesmane sesquiterpenoid
1 reference
inferred from
eudesmane sesquiterpenoid
mass
261.155120736
dalton
1 reference
based on heuristic
inferred from SMILES
chemical formula
C₁₆H₂₃NS
0 references
canonical SMILES
S=C=NC1C(C(=C)C)CCC2(C)CCCC(=C)C12
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found in taxon
Axinyssa isabela
1 reference
stated in
Sesquiterpenes from the sponge Axinyssa isabela.
Identifiers
InChI
InChI=1S/C16H23NS/c1-11(2)13-7-9-16(4)8-5-6-12(3)14(16)15(13)17-10-18/h13-15H,1,3,5-9H2,2,4H3
0 references
InChIKey
SHAQBLJCKSUCHA-UHFFFAOYSA-N
0 references
PubChem CID
75053597
2 references
stated in
PubChem
retrieved
17 September 2022
based on heuristic
inferred from InChIKey
matched by identifier from
InChIKey
InChIKey
SHAQBLJCKSUCHA-UHFFFAOYSA-N
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