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(Q105151840)
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English
1-[(5Z)-12-(pyridin-3-yl)dodec-5-en-1-yl]-5-[(2Z)-9-(pyridin-3-yl)non-2-en-1-yl]-2H-pyridin-2-yl
chemical compound
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Statements
instance of
type of chemical entity
0 references
subclass of
pyridine alkaloids
0 references
3-alkylpiperidine alkaloid
0 references
mass
524.4004736
dalton
1 reference
based on heuristic
inferred from SMILES
chemical formula
C₃₆H₅₀N₃
0 references
canonical SMILES
N=1C=CC=C(C1)CCCCCCC=CCC=2C=C[CH]N(C2)CCCCC=CCCCCCCC=3C=NC=CC3
0 references
isomeric SMILES
[CH]1C=CC(C/C=C\CCCCCCc2cccnc2)=CN1CCCC/C=C\CCCCCCc1cccnc1
1 reference
based on heuristic
inferred from InChI
found in taxon
Callyspongia
1 reference
stated in
Niphatoxin C, a cytotoxic tripyridine alkaloid from Callyspongia sp.
Identifiers
InChI
InChI=1S/C36H50N3/c1(3-6-10-14-21-34-24-18-27-37-31-34)2-4-9-13-17-29-39-30-20-26-36(33-39)23-16-12-8-5-7-11-15-22-35-25-19-28-38-32-35/h2,4,12,16,18-20,24-28,30-33H,1,3,5-11,13-15,17,21-23,29H2/b4-2-,16-12-
0 references
InChIKey
LHLWHDYVFRGCSC-JXSNUWOOSA-N
0 references
KNApSAcK ID
C00039854
2 references
based on heuristic
inferred from InChIKey
matched by identifier from
InChIKey
InChIKey
LHLWHDYVFRGCSC-JXSNUWOOSA-N
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