Code7NR
Name9-Hydroxyoctadecanoic acid
Synonyms9-Hydroxystearic acid
Identifier(9~{S})-9-oxidanyloctadecanoic acid
FormulaC18 H36 O3
Molecular Weight300.477
SMILESCCCCCCCCC[C@@H](CCCCCCCC(=O)O)O
PubChem9601093
Formal Charge0
Total Atoms57
Total Chiral Atoms1
Total Bonds56
Total Aromatic Bonds0
Networks1
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This ligand is also present in the following network:
Show PDB Class SubFamily Type SubType Species Orthosteric Ligand Other Ligand(s) Protein Partners Resolution Date DOI
8ID3 A Lipid Free fatty acid FFA4 (GPR120) Homo sapiens 9-Hydroxystearic acid - Gi1/Beta1/Gamma2 3.1 2023-03-15  10.1126/science.add6220

A 2D representation of the interactions of 7NR in 8ID3
colored according to ConSurf Conservation Grade (See documentation): 

 n/a   1    2    3    4    5    6    7    8    9  

(Click to enlarge 🔍)
Node1 Node2 LinkStrength Comm IsNode1Hub? IsNode2Hub? Node1Cons Node2Cons Node1Shell Node2Shell
R:R:F25 R:R:F27 5.36 6 Yes No 5 5 2 1
R:R:F25 R:R:I287 7.54 6 Yes No 5 5 2 1
R:R:F25 R:R:I298 12.56 6 Yes Yes 5 3 2 2
R:R:F177 R:R:F27 4.29 0 No No 5 5 2 1
L:L:?1 R:R:F27 5.52 6 Yes No 0 5 0 1
R:R:F28 R:R:F303 6.43 6 Yes Yes 8 4 2 1
R:R:F28 R:R:V307 3.93 6 Yes No 8 5 2 2
R:R:F88 R:R:G122 3.01 0 Yes No 7 7 2 1
R:R:F88 R:R:W277 4.01 0 Yes Yes 7 9 2 1
R:R:A170 R:R:T119 3.36 0 No No 7 5 2 1
R:R:L173 R:R:T119 4.42 0 No No 5 5 2 1
L:L:?1 R:R:T119 8.01 6 Yes No 0 5 0 1
L:L:?1 R:R:G122 4.65 6 Yes No 0 7 0 1
R:R:T125 R:R:W277 3.64 0 No Yes 9 9 2 1
R:R:I126 R:R:W277 11.74 0 No Yes 8 9 2 1
R:R:L173 R:R:W207 9.11 0 No Yes 5 6 2 2
R:R:F176 R:R:W198 9.02 0 Yes Yes 5 7 2 1
R:R:F177 R:R:L196 13.4 0 No No 5 5 2 1
R:R:L196 R:R:W198 7.97 6 No Yes 5 7 1 1
L:L:?1 R:R:L196 3.76 6 Yes No 0 5 0 1
R:R:E204 R:R:W198 16.36 0 No Yes 5 7 2 1
R:R:W198 R:R:W207 5.62 6 Yes Yes 7 6 1 2
L:L:?1 R:R:W198 3.1 6 Yes Yes 0 7 0 1
R:R:E204 R:R:L288 5.3 0 No No 5 4 2 2
R:R:D208 R:R:W207 4.47 6 Yes Yes 5 6 1 2
R:R:F211 R:R:W207 12.03 0 No Yes 5 6 1 2
R:R:D208 R:R:I284 4.2 6 Yes No 5 5 1 1
R:R:D208 R:R:L288 8.14 6 Yes No 5 4 1 2
L:L:?1 R:R:D208 14.76 6 Yes Yes 0 5 0 1
R:R:F211 R:R:N215 8.46 0 No No 5 6 1 2
L:L:?1 R:R:F211 4.41 6 Yes No 0 5 0 1
R:R:I281 R:R:V212 4.61 0 No No 7 6 1 2
R:R:F216 R:R:I281 16.33 0 No No 8 7 2 1
R:R:T310 R:R:W277 3.64 0 No Yes 8 9 2 1
R:R:N313 R:R:W277 16.95 0 No Yes 9 9 2 1
L:L:?1 R:R:W277 3.1 6 Yes Yes 0 9 0 1
R:R:I280 R:R:V306 3.07 0 No No 6 6 1 2
R:R:I280 R:R:T310 4.56 0 No No 6 8 1 2
L:L:?1 R:R:I280 14.23 6 Yes No 0 6 0 1
L:L:?1 R:R:I281 5.17 6 Yes No 0 7 0 1
R:R:F303 R:R:T283 5.19 6 Yes Yes 4 5 1 2
R:R:T283 R:R:V306 3.17 0 Yes No 5 6 2 2
L:L:?1 R:R:I284 6.47 6 Yes No 0 5 0 1
R:R:I287 R:R:I298 2.94 6 No Yes 5 3 1 2
L:L:?1 R:R:I287 5.17 6 Yes No 0 5 0 1
R:R:F303 R:R:V307 3.93 6 Yes No 4 5 1 2
L:L:?1 R:R:F303 5.52 6 Yes Yes 0 4 0 1
StatisticsValue
Average Number Of Links13.00
Average Number Of Links With An Hub4.00
Average Interaction Strength6.45
Average Nodes In Shell35.00
Average Hubs In Shell12.00
Average Links In Shell47.00
Average Links Mediated by Hubs In Shell37.00
Physico-chemical properties of the nodes interacting with this ligand (click to enlarge 🔍)
Location of the nodes interacting with this ligand (click to enlarge 🔍)
StatisticsValue
Average Number Of Links13.00
Average Number Of Links With An Hub4.00
Average Interaction Strength6.45
Average Nodes In Shell35.00
Average Hubs In Shell12.00
Average Links In Shell47.00
Average Links Mediated by Hubs In Shell37.00

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Physico-chemical properties of the nodes interacting with this ligand

(Click to enlarge 🔍)

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Location of the nodes interacting with this ligand

(Click to enlarge 🔍)