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2-methyl-3-oxobutanoyl-CoA

Image of MNXM524
Properties
MNX_IDMNXM524
formulaC26H38N7O18P3S
charge-4
mass861.605
referencechebi:57335
InChIKeyNHNODHRSCRALBF-NQNBQJKNSA-J
InChIInChI=1S/C26H42N7O18P3S/c1-13(14(2)34)25(39)55-8-7-28-16(35)5-6-29-23(38)20(37)26(3,4)10-48-54(45,46)51-53(43,44)47-9-15-19(50-52(40,41)42)18(36)24(49-15)33-12-32-17-21(27)30-11-31-22(17)33/h11-13,15,18-20,24,36-37H,5-10H2,1-4H3,(H,28,35)(H,29,38)(H,43,44)(H,45,46)(H2,27,30,31)(H2,40,41,42)/p-4/t13?,15-,18-,19-,20+,24-/m1/s1
SMILESCC(C(C)=O)C(=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

This chemical compound does not exist in my selection



Occurrences of 2-methyl-3-oxobutanoyl-CoA in the MetaNetX repository

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Similar chemical compounds in external resources
IdentifierDescription
bigg:2maacoa 2-Methyl-3-acetoacetyl-CoA
chebi:11613
chebi:1195
chebi:15476
chebi:19687
2-Methyl-3-acetoacetyl-CoA
2-Methylacetoacetyl-CoA
2-methyl-3-acetoacetyl-CoA
2-methyl-3-acetoacetyl-coenzyme A
2-methylacetoacetyl-CoA
2-methylacetoacetyl-coenzyme A
3'-phosphoadenosine 5'-{3-[(3R)-3-hydroxy-2,2-dimethyl-4-{[3-({2-[(2-methyl-3-oxobutanoyl)sulfanyl]ethyl}amino)-3-oxopropyl]amino}-4-oxobutyl] dihydrogen diphosphate}
NHNODHRSCRALBF-NQNBQJKNSA-N
chebi:57335 2-methyl-3-oxobutanoyl-CoA
2-methylacetoacetyl-CoA tetraanion
2-methylacetoacetyl-CoA(4-)
2-methylacetoacetyl-coenzyme A(4-)
3'-phosphonatoadenosine 5'-{3-[(3R)-3-hydroxy-2,2-dimethyl-4-{[3-({2-[(2-methyl-3-oxobutanoyl)sulfanyl]ethyl}amino)-3-oxopropyl]amino}-4-oxobutyl]diphosphate}
NHNODHRSCRALBF-NQNBQJKNSA-J
hmdb:HMDB01157 2-Methylacetoacetyl-CoA
2-methylacetoacetyl-coa
{[5-(6-amino-9H-purin-9-yl)-4-hydroxy-2-({[hydroxy({[hydroxy(3-hydroxy-2,2-dimethyl-3-{[2-({2-[(2-methyl-3-oxobutanoyl)sulfanyl]ethyl}carbamoyl)ethyl]carbamoyl}propoxy)phosphoryl]oxy})phosphoryl]oxy}methyl)oxolan-3-yl]oxy}phosphonic acid
kegg:C03344
sabiork:6566
2-Methyl-3-acetoacetyl-CoA
2-Methylacetoacetyl-CoA
lipidmaps:LMFA07050189 2-Methylacetoacetyl-CoA
2-methyl-3-acetoacetyl-coenzyme A
2-methylacetoacetyl-coenzyme A
3'-phosphoadenosine 5'-{3-[(3R)-3-hydroxy-2,2-dimethyl-4-{[3-({2-[(2-methyl-3-oxobutanoyl)sulfanyl]ethyl}amino)-3-oxopropyl]amino}-4-oxobutyl] dihydrogen diphosphate}
lipidmaps:LMFA07050189
metacyc:2-METHYL-ACETO-ACETYL-COA 2-METHYL-ACETO-ACETYL-COA
2-methyl-3-acetoacetyl-CoA
2-methylacetoacetyl coenzyme A
2-methylacetoacetyl-CoA
reactome:70836 2-methylacetoacetyl-CoA
2MACA-CoA
alpha-methylacetoacetyl-CoA
seed:cpd02124 2-Methyl-3-acetoacetyl-CoA
2-Methylacetoacetyl-CoA
2-methyl-acetoacetyl-CoA
2maacoa
M_2_Methyl_3_acetoacetyl_CoA
deprecated:MNXM89785
deprecated:MNXM91388