16-Hydroxyhexadecanoic acid

Details

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Internal ID c4dfc457-6cd2-4b7a-a784-cfae2ca230f8
Taxonomy Lipids and lipid-like molecules > Fatty Acyls > Fatty acids and conjugates > Long-chain fatty acids
IUPAC Name 16-hydroxyhexadecanoic acid
SMILES (Canonical) C(CCCCCCCC(=O)O)CCCCCCCO
SMILES (Isomeric) C(CCCCCCCC(=O)O)CCCCCCCO
InChI InChI=1S/C16H32O3/c17-15-13-11-9-7-5-3-1-2-4-6-8-10-12-14-16(18)19/h17H,1-15H2,(H,18,19)
InChI Key UGAGPNKCDRTDHP-UHFFFAOYSA-N
Popularity 195 references in papers

Physical and Chemical Properties

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Molecular Formula C16H32O3
Molecular Weight 272.42 g/mol
Exact Mass 272.23514488 g/mol
Topological Polar Surface Area (TPSA) 57.50 Ų
XlogP 4.80

Synonyms

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506-13-8
Juniperic acid
16-HYDROXYPALMITIC ACID
Hexadecanoic acid, 16-hydroxy-
Palmitic acid, 16-hydroxy-
omega-Hydroxypalmitic acid
16-hydroxy-hexadecanoic acid
16-HydroxyhexadecanoicAcid
.omega.-Hydroxypalmitic acid
MFCD00002750
There are more than 10 synonyms. If you wish to see them all click here.

2D Structure

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2D Structure of 16-Hydroxyhexadecanoic acid

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
CHEMBL3251 P19838 Nuclear factor NF-kappa-B p105 subunit 92.95% 96.09%
CHEMBL3060 Q9Y345 Glycine transporter 2 92.46% 99.17%
CHEMBL5285 Q99683 Mitogen-activated protein kinase kinase kinase 5 87.08% 92.26%
CHEMBL4040 P28482 MAP kinase ERK2 85.81% 83.82%
CHEMBL1781 P11387 DNA topoisomerase I 83.61% 97.00%
CHEMBL2581 P07339 Cathepsin D 83.26% 98.95%
CHEMBL5619 P27695 DNA-(apurinic or apyrimidinic site) lyase 82.22% 91.11%

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.
Arabidopsis thaliana
Pinus radiata
Rosmarinus officinalis

Cross-Links

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PubChem 10466
LOTUS LTS0167187
wikiData Q27124231