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(Q105140534)
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3-[(12E)-henicos-12-en-1-yl]-1H-pyrrole-2-carbaldehyde
chemical compound
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Statements
instance of
type of chemical entity
0 references
subclass of
pyrrole alkaloid
0 references
mass
387.35011506
dalton
1 reference
based on heuristic
inferred from SMILES
chemical formula
C₂₆H₄₅NO
0 references
canonical SMILES
O=CC=1NC=CC1CCCCCCCCCCCC=CCCCCCCCC
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isomeric SMILES
CCCCCCCC/C=C/CCCCCCCCCCCc1cc[nH]c1C=O
1 reference
based on heuristic
inferred from InChI
found in taxon
Oscarella lobularis
1 reference
stated in
Long alkyl chains-3-substituted pyrrole-2-aldehyde (-2-carboxylic acid and methyl ester) from the marine spongeOscarella lobularis
Identifiers
InChI
InChI=1S/C26H45NO/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-25-22-23-27-26(25)24-28/h9-10,22-24,27H,2-8,11-21H2,1H3/b10-9+
0 references
InChIKey
KFRXOZCUEVYJHK-MDZDMXLPSA-N
0 references
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