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formyl-CoA

MNXM563 is deprecated and here replaced by MNXM738242
!!! Alternative mappings exist !!!

Properties

Image

Occurences in reactions

MNX_ID

MNXM738242

	#reac
in my sandbox	0
in MNXref (generic)	17
in models (compartimentalized)	17

formula

C₂₂H₃₂N₇O₁₇P₃S

charge

-4

mass

791.08102

reference

chebi:57376

InChIKey

SXMOKYXNAPLNCW-GORZOVPNSA-J

InChI

InChI=1S/C22H36N7O17P3S/c1-22(2,17(33)20(34)25-4-3-13(31)24-5-6-50-11-30)8-43-49(40,41)46-48(38,39)42-7-12-16(45-47(35,36)37)15(32)21(44-12)29-10-28-14-18(23)26-9-27-19(14)29/h9-12,15-17,21,32-33H,3-8H2,1-2H3,(H,24,31)(H,25,34)(H,38,39)(H,40,41)(H2,23,26,27)(H2,35,36,37)/p-4/t12-,15-,16-,17+,21-/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

Parent-child relations graph

Deprecated MNXref IDs graph

Similar chemical compounds in external resources
Identifier	Description
CHEBI:57376 chebi:57376	formyl-CoA 3'-phosphonatoadenosine 5'-(3-{(3R)-4-[(3-{[2-(formylsulfanyl)ethyl]amino}-3-oxopropyl)amino]-3-hydroxy-2,2-dimethyl-4-oxobutyl} diphosphate) formyl-CoA(4-)
sabiork.compound:2158 sabiorkM:2158 kegg.compound:C00798 keggC:C00798	Formyl-CoA
bigg.metabolite:forcoa biggM:forcoa	Formyl-CoA(4-)
seed.compound:cpd00592 seedM:cpd00592	Formyl-CoA forcoa formyl-CoA
metacyc.compound:FORMYL-COA metacycM:FORMYL-COA	formyl-CoA
reactome:R-ALL-389578 reactomeM:R-ALL-389578 CHEBI:15522 chebi:15522	formyl-CoA 3'-phosphoadenosine 5'-(3-{(3R)-4-[(3-{[2-(formylsulfanyl)ethyl]amino}-3-oxopropyl)amino]-3-hydroxy-2,2-dimethyl-4-oxobutyl} dihydrogen diphosphate) Formyl-CoA formyl-coenzyme A
chebi:14282 chebi:24092 chebi:49609 chebi:5150 biggM:M_forcoa keggC:M_C00798 seedM:M_cpd00592	secondary/obsolete/fantasy identifier