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(9Z,12Z,15Z,18Z,21Z)-3-oxotetracosapentaenoyl-CoA

PropertiesImageOccurences in reactions
MNX_IDMNXM145832Image of MNXM145832
#reac
in my sandbox 0
in MNXref (generic)2
in models (compartimentalized) 1
formulaC45H66N7O18P3S
charge-4
mass1117.34198
referencechebi:73871
InChIKeyUQPANOGFYCZRAV-AFQBPCMKSA-J
InChIInChI=1S/C45H70N7O18P3S/c1-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-23-33(53)28-36(55)74-27-26-47-35(54)24-25-48-43(58)40(57)45(2,3)30-67-73(64,65)70-72(62,63)66-29-34-39(69-71(59,60)61)38(56)44(68-34)52-32-51-37-41(46)49-31-50-42(37)52/h5-6,8-9,11-12,14-15,17-18,31-32,34,38-40,44,56-57H,4,7,10,13,16,19-30H2,1-3H3,(H,47,54)(H,48,58)(H,62,63)(H,64,65)(H2,46,49,50)(H2,59,60,61)/p-4/b6-5-,9-8-,12-11-,15-14-,18-17-/t34-,38-,39-,40+,44-/m1/s1
SMILESCC/C=C\C/C=C\C/C=C\C/C=C\C/C=C\CCCCCC(=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:73871
chebi:73871 		(9Z,12Z,15Z,18Z,21Z)-3-oxotetracosapentaenoyl-CoA
(9Z,12Z,15Z,18Z,21Z)-3-oxotetracosapentaenoyl-CoA(4-)
(9Z,12Z,15Z,18Z,21Z)-3-oxotetracosapentaenoyl-coenzyme A(4-)
3'-phosphonatoadenosine 5'-{3-[(3R)-4-({3-[(2-{[(9Z,12Z,15Z,18Z,21Z)-3-oxotetracosa-7,10,13,16,19,21-pentaenoyl]sulfanyl}ethyl)amino]-3-oxopropyl}amino)-3-hydroxy-2,2-dimethyl-4-oxobutyl] diphosphate}
seed.compound:cpd31724
seedM:cpd31724 		(9Z,12Z,15Z,18Z,21Z)-3-oxotetracosa-9,12,15,18,21-pentaenoyl-CoA
(9Z,12Z,15Z,18Z,21Z)-3-oxotetracosapentaenoyl-CoA
3-oxotetracosapentaenoyl-CoA
all-cis-9,12,15,18,21-3-oxotetracosapentaenoyl-CoA
metacyc.compound:CPD-17332
metacycM:CPD-17332 		(9Z,12Z,15Z,18Z,21Z)-3-oxotetracosapentaenoyl-CoA
(9Z,12Z,15Z,18Z,21Z)-3-oxotetracosa-9,12,15,18,21-pentaenoyl-CoA
3-oxotetracosapentaenoyl-CoA
all-cis-9,12,15,18,21-3-oxotetracosapentaenoyl-CoA
CHEBI:73876
chebi:73876 		(9Z,12Z,15Z,18Z,21Z)-3-oxotetracosapentaenoyl-CoA
(9Z,12Z,15Z,18Z,21Z)-3-oxotetracosapentaenoyl-coenzyme A
3'-phosphoadenosine 5'-{3-[(3R)-4-({3-[(2-{[(9Z,12Z,15Z,18Z,21Z)-3-oxotetracosa-7,10,13,16,19,21-pentaenoyl]sulfanyl}ethyl)amino]-3-oxopropyl}amino)-3-hydroxy-2,2-dimethyl-4-oxobutyl] dihydrogen diphosphate}
lipidmaps:LMFA07050140
lipidmapsM:LMFA07050140 		(9Z,12Z,15Z,18Z,21Z)-3-oxotetracosapentaenoyl-CoA
(9Z,12Z,15Z,18Z,21Z)-3-oxotetracosapentaenoyl-coenzyme A
3'-phosphoadenosine 5'-{3-[(3R)-4-({3-[(2-{[(9Z,12Z,15Z,18Z,21Z)-3-oxotetracosa-7,10,13,16,19,21-pentaenoyl]sulfanyl}ethyl)amino]-3-oxopropyl}amino)-3-hydroxy-2,2-dimethyl-4-oxobutyl] dihydrogen diphosphate}
CoA 24:6
O
SLM:000000735
slm:000000735 		3-oxo-(9Z,12Z,15Z,18Z,21Z)-tetracosapentaenoyl-CoA
seedM:M_cpd31724 secondary/obsolete/fantasy identifier