Concept information
Preferred term
3 oxotetracosanoyl CoA(4)
Type
-
http://www.irandoc.ac.ir/onto/irandoc-meta/Concept
Broader concept
charge
- -4
formula
- C45H76N7O18P3S
inchi
- InChI=1S/C45H80N7O18P3S/c1-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-23-33(53)28-36(55)74-27-26-47-35(54)24-25-48-43(58)40(57)45(2,3)30-67-73(64,65)70-72(62,63)66-29-34-39(69-71(59,60)61)38(56)44(68-34)52-32-51-37-41(46)49-31-50-42(37)52/h31-32,34,38-40,44,56-57H,4-30H2,1-3H3,(H,47,54)(H,48,58)(H,62,63)(H,64,65)(H2,46,49,50)(H2,59,60,61)/p-4/t34-,38-,39-,40+,44-/m1/s1
inchikey
- JJSJTIWFKNSCHC-JBKAVQFISA-J
is_conjugate_base_of
mass
- 1128.10700
monoisotopicmass
- 1127.42024
smiles
- CCCCCCCCCCCCCCCCCCCCCC(=O)CC(=O)SCCNC(=O)CCNC(=O)[C@H](O)C(C)(C)COP([O-])(=O)OP([O-])(=O)OC[C@H]1O[C@H]([C@H](O)[C@@H]1OP([O-])([O-])=O)n1cnc2c(N)ncnc12
subset
- 3_STAR
synonym EXACT
- 3'-phosphonatoadenosine 5'-{3-[(3R)-3-hydroxy-2,2-dimethyl-4-oxo-4-{[3-({2-[(3-oxotetracosanoyl)sulfanyl]ethyl}amino)-3-oxopropyl]amino}butyl] diphosphate}
synonym RELATED
- 3-keto-C24-CoA(4-)
- 3-ketolignoceroyl-CoA(4-)
- 3-ketolignoceroyl-coenzyme A(4-)
- 3-ketotetracosanoyl-CoA(4-)
- 3-ketotetracosanoyl-coenzyme A(4-)
- 3-oxo-C24-CoA(4-)
- 3-oxolignoceroyl-CoA(4-)
- 3-oxolignoceroyl-coenzyme A(4-)
- 3-oxotetracosanoyl-CoA
- 3-oxotetracosanoyl-coenzyme A(4-)
In other languages
-
English
URI
http://www.irandoc.acir/onto/irandoc/CHEBI:73977
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