Feedback

N-methylanthraniloyl-CoA

Properties

Image

Occurences in reactions

MNX_ID

MNXM3070

	#reac
in my sandbox	0
in MNXref (generic)	4
in models (compartimentalized)	0

formula

C₂₉H₃₉N₈O₁₇P₃S

charge

-4

mass

896.13887

reference

chebi:58630

InChIKey

DYCZFHXLKCLDQL-SXQYHYLKSA-J

InChI

InChI=1S/C29H43N8O17P3S/c1-29(2,23(40)26(41)33-9-8-19(38)32-10-11-58-28(42)16-6-4-5-7-17(16)31-3)13-51-57(48,49)54-56(46,47)50-12-18-22(53-55(43,44)45)21(39)27(52-18)37-15-36-20-24(30)34-14-35-25(20)37/h4-7,14-15,18,21-23,27,31,39-40H,8-13H2,1-3H3,(H,32,38)(H,33,41)(H,46,47)(H,48,49)(H2,30,34,35)(H2,43,44,45)/p-4/t18-,21-,22-,23+,27-/m1/s1

SMILES

CNc1ccccc1C(=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-]

Parent-child relations graph

Deprecated MNXref IDs graph

Similar chemical compounds in external resources
Identifier	Description
CHEBI:58630 chebi:58630	N-methylanthraniloyl-CoA 3'-phosphonatoadenosine 5'-{3-[3-hydroxy-2,2-dimethyl-4-({3-[(2-{[2-(methylamino)benzoyl]sulfanyl}ethyl)amino]-3-oxopropyl}amino)-4-oxobutyl] diphosphate} N-methylanthraniloyl-CoA tetraanion N-methylanthraniloyl-CoA(4-) N-methylanthraniloyl-coenzyme A(4-) S-(2-aminobenzoyl)-CoA(4-)
sabiork.compound:14130 sabiorkM:14130 kegg.compound:C12092 keggC:C12092	N-Methylanthraniloyl-CoA
seed.compound:cpd08876 seedM:cpd08876	N-Methylanthraniloyl-CoA N-methylanthraniloyl-CoA
metacyc.compound:N-METHYLANTHRANILOYL-COA metacycM:N-METHYLANTHRANILOYL-COA	N-methylanthraniloyl-CoA
CHEBI:30305 chebi:30305	N-methylanthraniloyl-CoA 3'-phosphoadenosine 5'-{3-[3-hydroxy-2,2-dimethyl-4-({3-[(2-{[2-(methylamino)benzoyl]sulfanyl}ethyl)amino]-3-oxopropyl}amino)-4-oxobutyl] dihydrogen diphosphate} N-Methylanthraniloyl-CoA N-methylanthraniloyl-coenzyme A N-methylanthranilyl-CoA N-methylanthranilyl-coenzyme A S-[2-(methylamino)benzoyl]-coenzyme A
lipidmaps:LMFA07050353 lipidmapsM:LMFA07050353	N-methylanthraniloyl-CoA N-methylanthraniloyl-CoA N-methylanthraniloyl-coenzyme A N-methylanthranilyl-CoA N-methylanthranilyl-coenzyme A S-[2-(methylamino)benzoyl]-coenzyme A
chebi:12607 chebi:29645 keggC:M_C12092 seedM:M_cpd08876	secondary/obsolete/fantasy identifier