(R)-3-hydroxyoctanoyl-CoA (CHEBI:28573)

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CHEBI:28573 - (R)-3-hydroxyoctanoyl-CoA

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ChEBI ID	CHEBI:28573
ChEBI Name	(R)-3-hydroxyoctanoyl-CoA
Stars
ASCII Name	(R)-3-hydroxyoctanoyl-CoA
Definition	An (R)-3-hydroxyacyl-CoA that results from the formal condensation of the thiol group of coenzyme A with the carboxy group of (R)-3-hydroxyoctanoic acid.
Secondary ChEBI IDs	CHEBI:324, CHEBI:18668
Last Modified	2 July 2013
Downloads	Molfile

Formula	C29H50N7O18P3S
Net Charge	0
Average Mass	909.739
Monoisotopic Mass	909.21459
SMILES	CCCCC[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](n2cnc3c(N)ncnc32)[C@H](O)[C@@H]1OP(=O)(O)O
InChI	InChI=1S/C29H50N7O18P3S/c1-4-5-6-7-17(37)12-20(39)58-11-10-31-19(38)8-9-32-27(42)24(41)29(2,3)14-51-57(48,49)54-56(46,47)50-13-18-23(53-55(43,44)45)22(40)28(52-18)36-16-35-21-25(30)33-15-34-26(21)36/h15-18,22-24,28,37,40-41H,4-14H2,1-3H3,(H,31,38)(H,32,42)(H,46,47)(H,48,49)(H2,30,33,34)(H2,43,44,45)/t17-,18-,22-,23-,24+,28-/m1/s1
InChIKey	ATVGTMKWKDUCMS-JWBYWSJJSA-N

Roles Classification

acyl donor Any donor that can transfer acyl groups between molecular entities.

ChEBI Ontology

Outgoing Relation(s)
	(R)-3-hydroxyoctanoyl-CoA (CHEBI:28573) has functional parent (R)-3-hydroxyoctanoic acid (CHEBI:37099)
	(R)-3-hydroxyoctanoyl-CoA (CHEBI:28573) has functional parent octanoyl-CoA (CHEBI:15533)
	(R)-3-hydroxyoctanoyl-CoA (CHEBI:28573) is a (R)-3-hydroxyacyl-CoA (CHEBI:15456)
	(R)-3-hydroxyoctanoyl-CoA (CHEBI:28573) is a hydroxy fatty acyl-CoA (CHEBI:61902)
	(R)-3-hydroxyoctanoyl-CoA (CHEBI:28573) is conjugate acid of (R)-3-hydroxyoctanoyl-CoA(4−) (CHEBI:74279)
Incoming Relation(s)
Incoming Relation(s)	(R)-3-hydroxyoctanoyl-CoA(4−) (CHEBI:74279) is conjugate base of (R)-3-hydroxyoctanoyl-CoA (CHEBI:28573)

IUPAC Name
3'-phosphoadenosine 5'-{3-[(3R)-3-hydroxy-4-({3-[(2-{[(3R)-3-hydroxyoctanoyl]sulfanyl}ethyl)amino]-3-oxopropyl}amino)-2,2-dimethyl-4-oxobutyl] dihydrogen diphosphate}

Synonyms	Source
(R)-3-Hydroxycapryloyl-CoA	KEGG COMPOUND
(R)-3-hydroxycapryloyl-coenzyme A	ChEBI
(R)-3-hydroxyoctanoyl-coenzyme A	ChEBI

Manual Xrefs	Databases
C05278	KEGG COMPOUND

Citations