General Information of the Compound
| Compound ID |
CP0391022
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| Compound Name |
(Z)-N-[(1R,2S,5R)-5-methyl-2-propan-2-ylcyclohexyl]nonadec-10-enamide
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| Structure |
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| Formula |
C29H55NO
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| Molecular Weight |
433.765
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| Canonical SMILES |
CCCCCCCC\C=C/CCCCCCCCC(=O)N[C@@H]1C[C@H](C)CC[C@H]1C(C)C
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| InChI |
InChI=1S/C29H55NO/c1-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-29(31)30-28-24-26(4)22-23-27(28)25(2)3/h12-13,25-28H,5-11,14-24H2,1-4H3,(H,30,31)/b13-12-/t26-,27+,28-/m1/s1
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| InChIKey |
LKMVDURQBQLSMU-BPASWXHBSA-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