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(2E)-dodecenoyl-CoA

PropertiesImageOccurences in reactions
MNX_IDMNXM1104661Image of MNXM1104661
#reac
in my sandbox 0
in MNXref (generic)18
in models (compartimentalized) 29
formulaC33H52N7O17P3S
charge-4
mass943.23752
referencechebi:57330
InChIKeyIRFYVBULXZMEDE-DEEZISNZSA-J
InChIInChI=1S/C33H56N7O17P3S/c1-4-5-6-7-8-9-10-11-12-13-24(42)61-17-16-35-23(41)14-15-36-31(45)28(44)33(2,3)19-54-60(51,52)57-59(49,50)53-18-22-27(56-58(46,47)48)26(43)32(55-22)40-21-39-25-29(34)37-20-38-30(25)40/h12-13,20-22,26-28,32,43-44H,4-11,14-19H2,1-3H3,(H,35,41)(H,36,45)(H,49,50)(H,51,52)(H2,34,37,38)(H2,46,47,48)/p-4/b13-12+/t22-,26-,27-,28+,32-/m1/s1
SMILESCCCCCCCCC/C=C/C(=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:57330
chebi:57330
(2E)-dodecenoyl-CoA
3'-phosphonatoadenosine 5'-{3-[(3R)-4-({3-[(2-{[(2E)-dodec-2-enoyl]sulfanyl}ethyl)amino]-3-oxopropyl}amino)-3-hydroxy-2,2-dimethyl-4-oxobutyl] diphosphate}
trans-dodec-2-enoyl-CoA(4-)
seed.compound:cpd02060
seedM:cpd02060
(2E)-Dodecenoyl-CoA
(2E)-Dodec-2-enoyl-CoA
(2E)-dodec-2-enoyl-CoA
(2E)-dodecenoyl-CoA
2-trans-Dodecenoyl-CoA
2-trans-dodecenoyl-CoA
trans-Dodec-2-enoyl-CoA
trans-dd2coa
trans-dodec-2-enoyl-CoA
metacyc.compound:CPD-7222
metacycM:CPD-7222
(2E)-dodec-2-enoyl-CoA
(2E)-dodecenoyl-CoA
2-trans-dodecenoyl-CoA
trans-dodec-2-enoyl-CoA
SLM:000000909
slm:000000909
(2E)-dodecenoyl-CoA
kegg.compound:C03221
keggC:C03221
2-trans-Dodecenoyl-CoA
(2E)-Dodec-2-enoyl-CoA
(2E)-Dodecenoyl-CoA
sabiork.compound:2706
sabiorkM:2706
2-trans-Dodecenoyl-CoA
(2E)-Dodec-2-enoyl-CoA
(2E)-Dodecenoyl-CoA
trans-Dodec-2-enoyl-CoA
lipidmaps:LMFA07050176
lipidmapsM:LMFA07050176
2E-Dodecenoyl-CoA
3'-phosphoadenosine 5'-{3-[(3R)-4-({3-[(2-{[(2E)-dodec-2-enoyl]sulfanyl}ethyl)amino]-3-oxopropyl}amino)-3-hydroxy-2,2-dimethyl-4-oxobutyl] dihydrogen diphosphate}
CoA 12:1
bigg.metabolite:dd2coa
biggM:dd2coa
Trans-Dodec-2-enoyl-CoA
reactome:R-ALL-77255
reactomeM:R-ALL-77255
CHEBI:15471
chebi:15471
trans-dodec-2-enoyl-CoA
(2E)-Dodec-2-enoyl-CoA
(2E)-Dodecenoyl-CoA
2-trans-Dodecenoyl-CoA
3'-phosphoadenosine 5'-{3-[(3R)-4-({3-[(2-{[(2E)-dodec-2-enoyl]sulfanyl}ethyl)amino]-3-oxopropyl}amino)-3-hydroxy-2,2-dimethyl-4-oxobutyl] dihydrogen diphosphate}
chebi:11489
chebi:1287
chebi:19790
biggM:M_dd2coa
keggC:M_C03221
seedM:M_cpd02060
secondary/obsolete/fantasy identifier