N-benzyloleamide

Details

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Internal ID de923152-7339-48ea-92dd-d74f0d1a2c03
Taxonomy Lipids and lipid-like molecules > Fatty Acyls > Fatty amides > N-acyl amines
IUPAC Name (Z)-N-benzyloctadec-9-enamide
SMILES (Canonical) CCCCCCCCC=CCCCCCCCC(=O)NCC1=CC=CC=C1
SMILES (Isomeric) CCCCCCCC/C=C\CCCCCCCC(=O)NCC1=CC=CC=C1
InChI InChI=1S/C25H41NO/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-19-22-25(27)26-23-24-20-17-16-18-21-24/h9-10,16-18,20-21H,2-8,11-15,19,22-23H2,1H3,(H,26,27)/b10-9-
InChI Key QHXGFOCPQQADIF-KTKRTIGZSA-N
Popularity 11 references in papers

Physical and Chemical Properties

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Molecular Formula C25H41NO
Molecular Weight 371.60 g/mol
Exact Mass 371.318814931 g/mol
Topological Polar Surface Area (TPSA) 29.10 Ų
XlogP 8.50

Synonyms

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CHEMBL1223510
N-(9Z-octadecenoyl) benzylamine
101762-87-2
Oleamide, N-benzyl-
SCHEMBL3675310
(Z)-N-benzyloctadec-9-enamide
QHXGFOCPQQADIF-KTKRTIGZSA-N
BDBM50438778
LMFA08020157
AKOS037514996
There are more than 10 synonyms. If you wish to see them all click here.

2D Structure

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2D Structure of N-benzyloleamide

3D Structure

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ADMET Properties (via admetSAR 2)

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Target Value Probability (raw) Probability (%)
No predicted properties yet!

Targets

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Proven Targets:

CHEMBL ID UniProt ID Name Min activity Assay type Source
No proven targets yet!

Predicted Targets (via Super-PRED):

CHEMBL ID UniProt ID Name Probability Model accuracy
CHEMBL2581 P07339 Cathepsin D 99.33% 98.95%
CHEMBL3060 Q9Y345 Glycine transporter 2 98.51% 99.17%
CHEMBL221 P23219 Cyclooxygenase-1 97.97% 90.17%
CHEMBL4769 O95749 Geranylgeranyl pyrophosphate synthetase 96.94% 92.08%
CHEMBL5619 P27695 DNA-(apurinic or apyrimidinic site) lyase 94.72% 91.11%
CHEMBL1781 P11387 DNA topoisomerase I 92.19% 97.00%
CHEMBL3251 P19838 Nuclear factor NF-kappa-B p105 subunit 91.32% 96.09%
CHEMBL3892 Q99500 Sphingosine 1-phosphate receptor Edg-3 91.25% 97.29%
CHEMBL3108638 O15164 Transcription intermediary factor 1-alpha 90.52% 95.56%
CHEMBL3401 O75469 Pregnane X receptor 89.62% 94.73%
CHEMBL3091268 Q92753 Nuclear receptor ROR-beta 88.27% 95.50%
CHEMBL5701 Q9H2K8 Serine/threonine-protein kinase TAO3 87.77% 96.67%
CHEMBL230 P35354 Cyclooxygenase-2 87.73% 89.63%
CHEMBL3902 P09211 Glutathione S-transferase Pi 84.65% 93.81%

Plants that contains it

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Below are displayed all the plants proven (via scientific papers) to contain this compound!
To see more specific details click the taxa you are interested in.
Lepidium meyenii

Cross-Links

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PubChem 49865534
LOTUS LTS0104282
wikiData Q76617089