Code7AB
Name(2E)-{(4E)-4-[(3E)-4-(2,6,6-trimethylcyclohex-1-en-1-yl)but-3-en-2-ylidene]cyclohex-2-en-1-ylidene}acetaldehyde
Synonyms
Identifier(2~{E})-2-[(4~{E})-4-[(~{E})-4-(2,6,6-trimethylcyclohexen-1-yl)but-3-en-2-ylidene]cyclohex-2-en-1-ylidene]ethanal
FormulaC21 H28 O
Molecular Weight296.446
SMILESCC1=C(C(CCC1)(C)C)/C=C/C(=C/2\CC/C(=C\C=O)/C=C2)/C
PubChem6438558
Formal Charge0
Total Atoms50
Total Chiral Atoms0
Total Bonds51
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
5TE5 A Sensory Opsins Rhodopsin Bos taurus 20-Methanoretinal - - 4.01 2017-03-15 10.1073/pnas.1617446114

A 2D representation of the interactions of 7AB in 5TE5
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:F91 R:R:K296 11.17 0 No Yes 7 7 2 1
R:R:E113 R:R:T94 14.11 2 No No 5 7 1 2
R:R:F293 R:R:T94 6.49 2 Yes No 5 7 2 2
R:R:E113 R:R:K296 13.5 2 No Yes 5 7 1 1
L:L:?2 R:R:E113 8.59 2 Yes No 0 5 0 1
L:L:?2 R:R:A117 7.66 2 Yes No 0 5 0 1
L:L:?2 R:R:T118 4.78 2 Yes No 0 4 0 1
R:R:E181 R:R:G188 6.55 2 Yes No 4 5 2 1
R:R:E181 R:R:Y191 5.61 2 Yes Yes 4 6 2 2
R:R:E181 R:R:Y268 10.1 2 Yes Yes 4 6 2 1
R:R:E181 R:R:M288 8.12 2 Yes Yes 4 4 2 2
L:L:?2 R:R:G188 4.16 2 Yes No 0 5 0 1
R:R:Y191 R:R:Y268 5.96 2 Yes Yes 6 6 2 1
R:R:F212 R:R:L216 6.09 0 No No 8 7 1 2
L:L:?2 R:R:F212 6.91 2 Yes No 0 8 0 1
R:R:F261 R:R:W265 19.04 0 Yes Yes 9 8 2 1
R:R:S298 R:R:W265 8.65 0 No Yes 9 8 2 1
L:L:?2 R:R:W265 12 2 Yes Yes 0 8 0 1
R:R:M288 R:R:Y268 4.79 2 Yes Yes 4 6 2 1
L:L:?2 R:R:Y268 29.45 2 Yes Yes 0 6 0 1
R:R:F293 R:R:K296 7.44 2 Yes Yes 5 7 2 1
L:L:?2 R:R:K296 10.29 2 Yes Yes 0 7 0 1
R:R:A295 R:R:W265 3.89 0 No Yes 8 8 2 1
R:R:A168 R:R:T118 3.36 0 No No 7 4 2 1
R:R:G121 R:R:W265 2.81 0 No Yes 7 8 2 1
StatisticsValue
Average Number Of Links8.00
Average Number Of Links With An Hub3.00
Average Interaction Strength10.48
Average Nodes In Shell21.00
Average Hubs In Shell9.00
Average Links In Shell25.00
Average Links Mediated by Hubs In Shell22.00
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 Links8.00
Average Number Of Links With An Hub3.00
Average Interaction Strength10.48
Average Nodes In Shell21.00
Average Hubs In Shell9.00
Average Links In Shell25.00
Average Links Mediated by Hubs In Shell22.00

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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 🔍)