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cis-3,4-dehydroadipyl-CoA

Properties
MNX_IDMNXM2649
formulaC27H37N7O19P3S
charge-5
mass888.605743
referencechebi:58786
Image of MNXM2649
InChIKeyVYSXESTVCZRDBA-LNGKRSAJSA-I
InChIInChI=1S/C27H42N7O19P3S/c1-27(2,22(40)25(41)30-8-7-16(35)29-9-10-57-18(38)6-4-3-5-17(36)37)12-50-56(47,48)53-55(45,46)49-11-15-21(52-54(42,43)44)20(39)26(51-15)34-14-33-19-23(28)31-13-32-24(19)34/h3-4,13-15,20-22,26,39-40H,5-12H2,1-2H3,(H,29,35)(H,30,41)(H,36,37)(H,45,46)(H,47,48)(H2,28,31,32)(H2,42,43,44)/p-5/b4-3-/t15-,20-,21-,22+,26-/m1/s1
SMILESCC(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)[C@@H](O)C(=O)NCCC(=O)NCCSC(=O)C\C=C/CC([O-])=O

Occurences in reactions

#reac
Distinct reactions in my sandbox 0
Distinct generic reactions in MNXref2
Distinct compatimentalized reactions in models0

Similar chemical compounds in external resources
IdentifierDescription
metacycM:CIS-34-DEHYDROADIPYL-COA cis-3,4-dehydroadipyl-CoA
chebi:58786 cis-3,4-dehydroadipyl-CoA
3'-phosphonatoadenosine 5'-{3-[(3R)-4-({3-[(2-{[(3Z)-5-carboxylatopent-3-enoyl]sulfanyl}ethyl)amino]-3-oxopropyl}amino)-3-hydroxy-2,2-dimethyl-4-oxobutyl] diphosphate}
cis-3,4-didehydroadipoyl-CoA(5-)
chebi:49179
lipidmaps:LMFA07050298
cis-3,4-didehydroadipoyl-CoA
3'-phosphoadenosine 5'-{3-[(3R)-4-({3-[(2-{[(3Z)-5-carboxypent-3-enoyl]sulfanyl}ethyl)amino]-3-oxopropyl}amino)-3-hydroxy-2,2-dimethyl-4-oxobutyl] dihydrogen diphosphate}
cis-3,4-dehydroadipyl-CoA
seedM:cpd20930 3,4-Didehydroadipyl-CoA
cis-3,4-Dehydroadipyl-CoA
cis-3,4-dehydroadipyl-CoA
keggC:M_C19682
seedM:M_cpd20930
secondary/obsolete/fantasy identifier
keggC:C19682 3,4-Didehydroadipyl-CoA
cis-3,4-Dehydroadipyl-CoA