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3,5-dioxodecanoyl-CoA

PropertiesImagewith InChI numberingOccurences in reactions
MNX_IDMNXM1373973 Image of MNXM1373973 Image of MNXM1373973
#reac
in my sandbox 0
in MNXref (generic)3
in models (compartimentalized) 0
formulaC31H46N7O19P3S
charge-4
mass945.728
referenceseedM:cpd31921
InChIKeyHKARBOJODOFSOJ-HSJNEKGZSA-J
InChIInChI=1S/C31H50N7O19P3S/c1-4-5-6-7-18(39)12-19(40)13-22(42)61-11-10-33-21(41)8-9-34-29(45)26(44)31(2,3)15-54-60(51,52)57-59(49,50)53-14-20-25(56-58(46,47)48)24(43)30(55-20)38-17-37-23-27(32)35-16-36-28(23)38/h12,16-17,20,24-26,30,39,43-44H,4-11,13-15H2,1-3H3,(H,33,41)(H,34,45)(H,49,50)(H,51,52)(H2,32,35,36)(H2,46,47,48)/p-4/t20-,24-,25-,26+,30-/m1/s1
SMILESCCCCCC(O)=CC(=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](N2C=NC3=C(N)N=CN=C32)[C@H](O)[C@@H]1OP(=O)([O-])[O-]
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Deprecated MNXref IDs graph
Similar chemical compounds in external resources
IdentifierDescription
seed.compound:cpd31921
seedM:cpd31921
3,5-dioxodecanoyl-CoA
seedM:M_cpd31921 secondary/obsolete/fantasy identifier