General Information of the Compound
| Compound ID |
CP0429551
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| Compound Name |
(5Z,8Z,11Z,13S,14Z)-13-methyl-N-prop-2-ynylicosa-5,8,11,14-tetraenamide
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| Structure |
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| Formula |
C24H37NO
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| Molecular Weight |
355.566
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| Canonical SMILES |
CCCCC\C=C/[C@H](C)\C=C/C\C=C/C\C=C/CCCC(=O)NCC#C
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| InChI |
InChI=1S/C24H37NO/c1-4-6-7-13-16-19-23(3)20-17-14-11-9-8-10-12-15-18-21-24(26)25-22-5-2/h2,9-12,16-17,19-20,23H,4,6-8,13-15,18,21-22H2,1,3H3,(H,25,26)/b11-9-,12-10-,19-16-,20-17-/t23-/m0/s1
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| InChIKey |
JZEKLPLXPWAQPT-NBRJUAPRSA-N
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| Physicochemical Property |
"RO5" indicates the cutoff set by lipinski's rule of five: (1) Molecular weight less than 500 Dalton; (2) xlogp less than 5; (3) No more than 5 hbonddonor (Hydrogen Bond Donor Count); (4) No more than 10 hbondacc (Hydrogen Bond Acceptor Count); (5) No more than 10 rotbonds (Rotatable Bond Count). Show/Hide
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Map of Molecular Bioactivity Related to the Compound
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Map of Molecular Bioactivity Related to the Compound Compound Cell Line Protein Bioactivity Value: <= 0.1 μM > 0.1 μM and <= 10 μM > 10 μM Imprecise Activity |
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Table of Molecular Bioactivities Related to the Compound
Protein ID: PT02190, Cannabinoid receptor 1
Protein ID: PT00834, Cannabinoid receptor 2
Protein ID: PT01998, Cannabinoid receptor 2