Structure via PubChem · Public domain (PubChem)
phytanoyl-CoA
Sign in to savePhytanoyl-CoA is a coenzyme A derivative of phytanic acid.
Chemical data
- Formula
- C41H74N7O17P3S
- Molecular weight
- 1062.1 g/mol
- IUPAC name
- S-[2-[3-[[(2R)-4-[[[(2R,3S,4R,5R)-5-(6-aminopurin-9-yl)-4-hydroxy-3-phosphonooxyoxolan-2-yl]methoxy-hydroxyphosphoryl]oxy-hydroxyphosphoryl]oxy-2-hydroxy-3,3-dimethylbutanoyl]amino]propanoylamino]ethyl] 3,7,11,15-tetramethylhexadecanethioate
- SMILES
- CC(C)CCCC(C)CCCC(C)CCCC(C)CC(=O)SCCNC(=O)CCNC(=O)[C@@H](C(C)(C)COP(=O)(O)OP(=O)(O)OC[C@@H]1[C@H]([C@H]([C@@H](O1)N2C=NC3=C(N=CN=C32)N)O)OP(=O)(O)O)O
- InChIKey
- NRJQGHHZMSOUEN-ZJGVPSKGSA-N
- XLogP
- 2.9
- Polar surface area
- 389 Ų
- H-bond donors
- 9
- H-bond acceptors
- 22
- Formal charge
- 0
via PubChem
Wikidata facts
- Subclass of
- primary metabolite
- Mass
- 1061.407475
Show 4 more facts
- isomeric SMILES
- CC(C)CCCC(C)CCCC(C)CCCC(C)CC(=O)SCCNC(=O)CCNC(=O)[C@H](O)C(C)(C)COP(=O)(O)OP(=O)(O)OC[C@H]1O[C@@H](n2cnc3c(N)ncnc32)[C@H](O)[C@@H]1OP(=O)(O)O
- chemical formula
- C₄₁H₇₄N₇O₁₇P₃S
- canonical SMILES
- CC(C)CCCC(C)CCCC(C)CCCC(C)CC(=O)SCCNC(=O)CCNC(=O)C(C(C)(C)COP(=O)(O)OP(=O)(O)OCC1C(C(C(O1)N2C=NC3=C2N=CN=C3N)O)OP(=O)(O)O)O
- found in taxon
- Homo sapiens
Sources (2)
via Wikidata · CC0
~1 min read
Encyclopedic overview
1 sectionsContents
- References
Phytanoyl-CoA is a coenzyme A derivative of phytanic acid.
The enzyme phytanoyl-CoA hydroxylase catalyses hydroxylation of phytanoyl-CoA.
Excerpted from Wikipedia’s “phytanoyl-CoA” article, available under the CC BY-SA 4.0 licence.