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3-oxodocosanoyl-CoA

MNXM36756 is deprecated and here replaced by MNXM1103369
!!! Alternative mappings exist !!!
PropertiesImageOccurences in reactions
MNX_IDMNXM1103369Image of MNXM1103369
#reac
in my sandbox 0
in MNXref (generic)5
in models (compartimentalized) 10
formulaC43H72N7O18P3S
charge-4
mass1099.38893
referencechebi:71451
InChIKeyRKCOGGUHKPTOQJ-GNSUAQHMSA-J
InChIInChI=1S/C43H76N7O18P3S/c1-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-31(51)26-34(53)72-25-24-45-33(52)22-23-46-41(56)38(55)43(2,3)28-65-71(62,63)68-70(60,61)64-27-32-37(67-69(57,58)59)36(54)42(66-32)50-30-49-35-39(44)47-29-48-40(35)50/h29-30,32,36-38,42,54-55H,4-28H2,1-3H3,(H,45,52)(H,46,56)(H,60,61)(H,62,63)(H2,44,47,48)(H2,57,58,59)/p-4/t32-,36-,37-,38+,42-/m1/s1
SMILESCCCCCCCCCCCCCCCCCCCC(=O)CC(=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
IdentifierDescription
CHEBI:71451
chebi:71451 		3-oxodocosanoyl-CoA
3'-phosphonatoadenosine 5'-{3-[(3R)-3-hydroxy-2,2-dimethyl-4-oxo-4-{[3-({2-[(3-oxodocosanoyl)sulfanyl]ethyl}amino)-3-oxopropyl]amino}butyl] diphosphate}
3-ketodocosanoyl-CoA(4-)
3-ketodocosanoyl-coenzyme A(4-)
3-oxobehenoyl-CoA
3-oxodocosanoyl-CoA(4-)
3-oxodocosanoyl-coenzyme A(4-)
hmdb:HMDB0060215 3-Oxodocosanoyl-CoA
3-Keto-C22-CoA
3-Ketobehenoyl-CoA
3-Ketodocosanoyl-CoA
3-Ketodocosanoyl-coenzyme A
3-Oxobehenoyl-CoA
3-Oxobehenoyl-coenzyme A
3-Oxodocosanoyl-coenzyme A
3-keto-C22-coa
{[(2R,3S,4R,5R)-5-(6-amino-9H-purin-9-yl)-4-hydroxy-2-({[hydroxy({hydroxy[(3R)-3-hydroxy-2,2-dimethyl-3-{[2-({2-[(3-oxodocosanoyl)sulfanyl]ethyl}carbamoyl)ethyl]carbamoyl}propoxy]phosphoryl}oxy)phosphoryl]oxy}methyl)oxolan-3-yl]oxy}phosphonic acid
lipidmaps:LMFA07050240
lipidmapsM:LMFA07050240 		3-ketodocosanoyl-CoA
3-keto-C22-CoA
3-ketobehenoyl-CoA
3-ketodocosanoyl-CoA
3-ketodocosanoyl-coenzyme A
3-oxobehenoyl-CoA
3-oxobehenoyl-coenzyme A
3-oxodocosanoyl-CoA
3-oxodocosanoyl-coenzyme A
CoA 22:1
O
seed.compound:cpd22630
seedM:cpd22630 		3-oxo-behenoyl-CoA
3-oxo-docosanoyl-CoA
metacyc.compound:CPD-10283
metacycM:CPD-10283 		3-oxobehenoyl-CoA
3-oxodocosanoyl-CoA
SLM:000000486
slm:000000486 		3-oxodocosanoyl-CoA
bigg.metabolite:CE2250
biggM:CE2250 		3-oxodocosanoyl-CoA(4-)
reactome:R-ALL-548829
reactomeM:R-ALL-548829
CHEBI:52328
chebi:52328 		3-oxodocosanoyl-CoA
3'-phosphoadenosine 5'-{3-[(3R)-3-hydroxy-2,2-dimethyl-4-oxo-4-{[3-({2-[(3-oxodocosanoyl)sulfanyl]ethyl}amino)-3-oxopropyl]amino}butyl] dihydrogen diphosphate}
3-keto-C22-CoA
3-ketobehenoyl-CoA
3-ketodocosanoyl-CoA
3-ketodocosanoyl-coenzyme A
3-oxobehenoyl-CoA
3-oxobehenoyl-coenzyme A
3-oxodocosanoyl-coenzyme A
hmdb:HMDB60215
biggM:M_CE2250
seedM:M_cpd22630 		secondary/obsolete/fantasy identifier