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(R)-carnitinyl-CoA

Properties

Image

Occurences in reactions

MNX_ID

MNXM728470

	#reac
in my sandbox	0
in MNXref (generic)	9
in models (compartimentalized)	10

formula

C₂₈H₄₆N₈O₁₈P₃S

charge

-3

mass

907.18801

reference

chebi:60932

InChIKey

BBRISSLDTUHWKG-PVMHLSDZSA-K

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

SMILES

CC(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-])[C@@H](O)C(=O)NCCC(=O)NCCSC(=O)C[C@@H](O)C[N+](C)(C)C

Parent-child relations graph

Deprecated MNXref IDs graph

Similar chemical compounds in external resources
Identifier	Description
CHEBI:60932 chebi:60932	(R)-carnitinyl-CoA (R)-carnitinyl-CoA(3-) L-carnitinyl-CoA(3-) R-carnitinyl-CoA(3-)
lipidmaps:LMFA07050150 lipidmapsM:LMFA07050150	(R)-carnitinyl-CoA betaine 2R-hydroxy-4-trimethylammonio-butanoyl-CoA L-CARNITINYL-COA INNER SALT L-carnitinyl-CoA betaine R-carnitinyl-CoA inner salt
CHEBI:41482 chebi:41482	(R)-carnitinyl-CoA betaine L-CARNITINYL-COA INNER SALT L-carnitinyl-CoA betaine R-carnitinyl-CoA inner salt
metacyc.compound:L-CARNITINYL-COA metacycM:L-CARNITINYL-COA	(R)-carnitinyl-CoA (3R)-3-hydroxy-4-(trimethylamino)butanoyl-CoA L-carnitinyl-CoA L-carnityl-CoA
seed.compound:cpd15440 seedM:cpd15440	Carnitinyl-CoA (3R)-3-hydroxy-4-(trimethylamino)butanoyl-CoA L-Carnitinyl-CoA L-carnitinyl-CoA L-carnityl-CoA crncoa
bigg.metabolite:crncoa biggM:crncoa sabiork.compound:31694 sabiorkM:31694 kegg.compound:C20750 keggC:C20750	L-Carnitinyl-CoA
biggM:M_crncoa keggC:M_C20750 seedM:M_cpd15440	secondary/obsolete/fantasy identifier