Hexadec-9-en-1-ol

Details

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Internal ID e5845bd1-b483-4662-98f5-015cd8b0354f
Taxonomy Lipids and lipid-like molecules > Fatty Acyls > Fatty alcohols > Long-chain fatty alcohols
IUPAC Name hexadec-9-en-1-ol
SMILES (Canonical)
SMILES (Isomeric)
InChI InChI=1S/C16H32O/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17/h7-8,17H,2-6,9-16H2,1H3
InChI Key LBIYNOAMNIKVKF-UHFFFAOYSA-N
Popularity 9 references in papers

Physical and Chemical Properties

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Molecular Formula C16H32O
Molecular Weight 240.42 g/mol
Exact Mass 240.245315640 g/mol
Topological Polar Surface Area (TPSA) 20.20 Ų
XlogP 7.10

Synonyms

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9-hexadecenyl alcohol
LBIYNOAMNIKVKF-UHFFFAOYSA-N
BCP23979
Q20054539

2D Structure

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2D Structure of Hexadec-9-en-1-ol

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
CHEMBL4769 O95749 Geranylgeranyl pyrophosphate synthetase 94.76% 92.08%
CHEMBL3060 Q9Y345 Glycine transporter 2 94.67% 99.17%
CHEMBL3892 Q99500 Sphingosine 1-phosphate receptor Edg-3 94.33% 97.29%
CHEMBL2885 P07451 Carbonic anhydrase III 93.95% 87.45%
CHEMBL230 P35354 Cyclooxygenase-2 93.85% 89.63%
CHEMBL2955 O95136 Sphingosine 1-phosphate receptor Edg-5 93.30% 92.86%
CHEMBL2581 P07339 Cathepsin D 90.37% 98.95%
CHEMBL5043 Q6P179 Endoplasmic reticulum aminopeptidase 2 88.21% 91.81%
CHEMBL3251 P19838 Nuclear factor NF-kappa-B p105 subunit 87.97% 96.09%
CHEMBL4793 Q86TI2 Dipeptidyl peptidase IX 85.59% 96.95%
CHEMBL1781 P11387 DNA topoisomerase I 85.44% 97.00%
CHEMBL2274 Q9H228 Sphingosine 1-phosphate receptor Edg-8 83.17% 100.00%
CHEMBL2265 P23141 Acyl coenzyme A:cholesterol acyltransferase 82.08% 85.94%
CHEMBL1977 P11473 Vitamin D receptor 80.25% 99.43%

Plants that contains it

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Below are displayed all the plants proven (via scientific papers) to contain this compound!
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There are no matching plants.

Cross-Links

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PubChem 82595
LOTUS LTS0213318
wikiData Q105149317