General Information of the Compound
Compound ID
CP0034055
Compound Name
(Z)-Octadec-9-enoic acid phenylamide
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Synonyms
(9Z)-N-phenyloctadec-9-enamide
(Z)-N-Phenyl-9-octadeceneamide
(Z)-N-phenyl-9-octadecenamide
(Z)-N-phenyloctadec-9-enamide
2-12-00-00150 (Beilstein Handbook Reference)
5429-85-6
9-Octadecenamide, N-phenyl-, (Z)-
AC1NS5WI
BRN 3533033
C24H39NO
CHEBI:53721
CHEMBL15611
EINECS 226-584-9
Epitope ID:117134
N-Phenyl-9Z-octadecenamide
NSC 14233
Octadec-9-enoic acid phenylamide
Oleanilide
Oleanilide (7CI)
Oleic acid anilide
Oleic anilide
Oleoylanilide
Oleyl anilide
Oleylanilide
SCHEMBL4143902
cis-9-Octadecenanilide
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Structure
Formula
C24H39NO
Molecular Weight
357.582
Canonical SMILES
CCCCCCCC\C=C/CCCCCCCC(=O)Nc1ccccc1
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InChI
InChI=1S/C24H39NO/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-19-22-24(26)25-23-20-17-16-18-21-23/h9-10,16-18,20-21H,2-8,11-15,19,22H2,1H3,(H,25,26)/b10-9-
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InChIKey
YPUOCYKJOLQYQS-KTKRTIGZSA-N
CAS
5429-85-6
Physicochemical Property
logP
7.6626
Rotatable Bonds
16
Heavy Atom Count
26
Polar Areas
29.1
Hydrogen Bond Donor Count
1
Hydrogen Bond Acceptor Count
1
Complexity
26

"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).

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PubChem ID
CID: 5354590
ChEMBL ID
CHEMBL15611
Map of Molecular Bioactivity Related to the Compound
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
Table of Molecular Bioactivities Related to the Compound
Protein ID: PT01327, Sterol O-acyltransferase 1
Cell-based Assay
Cell Line ID Cell Line Name Cell Line Organism
CL000023 BTI-Tn-5B1-4 Trichoplusia ni (Cabbage looper)  1
1
IC50 = 140 nM
   TI
   LI
   LO
   TS
Biochemical Assays
1 IC50 = 140 nM
2 IC50 = 170 nM
Protein ID: PT02407, Sterol O-acyltransferase 2
Cell-based Assay
Cell Line ID Cell Line Name Cell Line Organism
CL000023 BTI-Tn-5B1-4 Trichoplusia ni (Cabbage looper)  1
1
IC50 = 170 nM
   TI
   LI
   LO
   TS
Biochemical Assays
1 IC50 = 170 nM
Clinical Information about the Compound
Drug 1 ( Oleic acid anilide )
Drug Name Oleic acid anilide
Target(s)
Liver carboxylesterase (CES1)
Inhibitor
SOAT2 messenger RNA (SOAT2 mRNA)
Inhibitor