CHEBI:76465 - (R)-3-hydroxyhexacosanoyl-CoA

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ChEBI Name (R)-3-hydroxyhexacosanoyl-CoA
ChEBI ID CHEBI:76465
ChEBI ASCII Name (R)-3-hydroxyhexacosanoyl-CoA
Definition A 3-hydroxy fatty acyl-CoA that results from the formal condensation of the thiol group of coenzyme A with the carboxy group of (R)-3-hydroxyhexacosanoic acid [(R)-3-hydroxycerotic acid].
Stars This entity has been manually annotated by the ChEBI Team.
Supplier Information
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Formula C47H86N7O18P3S
Net Charge 0
Average Mass 1162.20800
Monoisotopic Mass 1161.49629
InChI InChI=1S/C47H86N7O18P3S/c1-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-23-24-25-35(55)30-38(57)76-29-28-49-37(56)26-27-50-45(60)42(59)47(2,3)32-69-75(66,67)72-74(64,65)68-31-36-41(71-73(61,62)63)40(58)46(70-36)54-34-53-39-43(48)51-33-52-44(39)54/h33-36,40-42,46,55,58-59H,4-32H2,1-3H3,(H,49,56)(H,50,60)(H,64,65)(H,66,67)(H2,48,51,52)(H2,61,62,63)/t35-,36-,40-,41-,42+,46-/m1/s1
InChIKey GBMJOTOUUWGTIA-CSLACTSSSA-N
SMILES CCCCCCCCCCCCCCCCCCCCCCC[C@@H](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
Roles Classification
Chemical Role(s): acyl donor
Any donor that can transfer acyl groups between molecular entities.
(via acyl-CoA )
View more via ChEBI Ontology
ChEBI Ontology
Outgoing (R)-3-hydroxyhexacosanoyl-CoA (CHEBI:76465) has functional parent hexacosanoic acid (CHEBI:31009)
(R)-3-hydroxyhexacosanoyl-CoA (CHEBI:76465) is a (R)-3-hydroxyacyl-CoA (CHEBI:15456)
(R)-3-hydroxyhexacosanoyl-CoA (CHEBI:76465) is a 3-hydroxy fatty acyl-CoA (CHEBI:20060)
(R)-3-hydroxyhexacosanoyl-CoA (CHEBI:76465) is a very long-chain fatty acyl-CoA (CHEBI:61910)
(R)-3-hydroxyhexacosanoyl-CoA (CHEBI:76465) is conjugate acid of (R)-3-hydroxyhexacosanoyl-CoA(4−) (CHEBI:76378)
Incoming (R)-3-hydroxyhexacosanoyl-CoA(4−) (CHEBI:76378) is conjugate base of (R)-3-hydroxyhexacosanoyl-CoA (CHEBI:76465)
IUPAC Name
3'-phosphoadenosine 5'-{3-[(3R)-3-hydroxy-4-({3-[(2-{[(3R)-3-hydroxyhexacosanoyl]sulfanyl}ethyl)amino]-3-oxopropyl}amino)-2,2-dimethyl-4-oxobutyl] dihydrogen diphosphate}
Synonyms Sources
(R)-3-hydroxycerotoyl-CoA ChEBI
(R)-3-hydroxycerotoyl-coenzyme A ChEBI
(R)-3-hydroxyhexacosanoyl-CoA ChEBI
(R)-3-hydroxyhexacosanoyl-coenzyme A ChEBI
Manual Xref Database
CPD-14278 MetaCyc
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Last Modified
05 February 2019