CHEBI:74474 - (R)-3-hydroxyhexanoyl-CoA

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ChEBI Name (R)-3-hydroxyhexanoyl-CoA
ChEBI ID CHEBI:74474
ChEBI ASCII Name (R)-3-hydroxyhexanoyl-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-hydroxyhexanoic acid.
Stars This entity has been manually annotated by the ChEBI Team.
Supplier Information
Download Molfile XML SDF
Formula C27H46N7O18P3S
Net Charge 0
Average Mass 881.67700
Monoisotopic Mass 881.18329
InChI InChI=1S/C27H46N7O18P3S/c1-4-5-15(35)10-18(37)56-9-8-29-17(36)6-7-30-25(40)22(39)27(2,3)12-49-55(46,47)52-54(44,45)48-11-16-21(51-53(41,42)43)20(38)26(50-16)34-14-33-19-23(28)31-13-32-24(19)34/h13-16,20-22,26,35,38-39H,4-12H2,1-3H3,(H,29,36)(H,30,40)(H,44,45)(H,46,47)(H2,28,31,32)(H2,41,42,43)/t15-,16-,20-,21-,22+,26-/m1/s1
InChIKey VAAHKRMGOFIORX-RLVCGTLZSA-N
SMILES CCC[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-hydroxyhexanoyl-CoA (CHEBI:74474) has functional parent hexanoic acid (CHEBI:30776)
(R)-3-hydroxyhexanoyl-CoA (CHEBI:74474) is a (R)-3-hydroxyacyl-CoA (CHEBI:15456)
(R)-3-hydroxyhexanoyl-CoA (CHEBI:74474) is a 3-hydroxy fatty acyl-CoA (CHEBI:20060)
(R)-3-hydroxyhexanoyl-CoA (CHEBI:74474) is a medium-chain fatty acyl-CoA (CHEBI:61907)
(R)-3-hydroxyhexanoyl-CoA (CHEBI:74474) is conjugate acid of (R)-3-hydroxyhexanoyl-CoA(4−) (CHEBI:74280)
Incoming (R)-3-hydroxyhexanoyl-CoA(4−) (CHEBI:74280) is conjugate base of (R)-3-hydroxyhexanoyl-CoA (CHEBI:74474)
Synonym Source
(R)-3-hydroxyhexanoyl-coenzyme A ChEBI
Manual Xref Database
CPD-14915 MetaCyc
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Last Modified
03 July 2013