CHEBI:60932 - (R)-carnitinyl-CoA(3−)

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ChEBI Name (R)-carnitinyl-CoA(3−)
ChEBI ID CHEBI:60932
ChEBI ASCII Name (R)-carnitinyl-CoA(3-)
Definition An acyl-CoA oxoanion obtained from (R)-carnitinyl-CoA betaine in which three protons have been removed from the phosphate groups.
Stars This entity has been manually annotated by the ChEBI Team.
Submitter Anne Morgat
Supplier Information
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Formula C28H46N8O18P3S
Net Charge -3
Average Mass 907.69400
Monoisotopic Mass 907.18801
InChI InChI=1S/C28H49N8O18P3S/c1-28(2,23(41)26(42)31-7-6-18(38)30-8-9-58-19(39)10-16(37)11-36(3,4)5)13-51-57(48,49)54-56(46,47)50-12-17-22(53-55(43,44)45)21(40)27(52-17)35-15-34-20-24(29)32-14-33-25(20)35/h14-17,21-23,27,37,40-41H,6-13H2,1-5H3,(H7-,29,30,31,32,33,38,42,43,44,45,46,47,48,49)/p-3/t16-,17-,21-,22-,23+,27-/m1/s1
InChIKey BBRISSLDTUHWKG-PVMHLSDZSA-K
SMILES CC(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)[C@@H](O)C(=O)NCCC(=O)NCCSC(=O)C[C@@H](O)C[N+](C)(C)C
ChEBI Ontology
Outgoing (R)-carnitinyl-CoA(3−) (CHEBI:60932) is a acyl-CoA oxoanion (CHEBI:58946)
(R)-carnitinyl-CoA(3−) (CHEBI:60932) is conjugate base of (R)-carnitinyl-CoA betaine (CHEBI:41482)
Incoming (R)-carnitinyl-CoA betaine (CHEBI:41482) is conjugate acid of (R)-carnitinyl-CoA(3−) (CHEBI:60932)
Synonyms Sources
(R)-carnitinyl-CoA UniProt
L-carnitinyl-CoA(3−) SUBMITTER
R-carnitinyl-CoA(3−) ChEBI
Manual Xref Database
L-CARNITINYL-COA MetaCyc
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Last Modified
21 February 2011
Submitter Remark
2011-01-10 16:50:39.0 Anne Morgat is correct -- the text area has been closed before I finished to write ;-)
2011-01-10 16:49:31.0 Anne Morgat Please, would you check that the stereochemistry of carnityl group