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10,11-dihydro-LTB4-CoA

PropertiesImageOccurences in reactions
MNX_IDMNXM162793Image of MNXM162793
#reac
in my sandbox 0
in MNXref (generic)3
in models (compartimentalized) 6
formulaC41H64N7O19P3S
charge-4
mass1083.32125
referencebiggM:CE5969
InChIKeyZYYSFSZTRFQEDO-DIXIOMTBSA-J
InChIInChI=1S/C41H68N7O19P3S/c1-4-5-6-7-8-11-15-28(49)16-12-9-10-13-17-29(50)18-14-19-32(52)71-23-22-43-31(51)20-21-44-39(55)36(54)41(2,3)25-64-70(61,62)67-69(59,60)63-24-30-35(66-68(56,57)58)34(53)40(65-30)48-27-47-33-37(42)45-26-46-38(33)48/h8-11,13,17,26-30,34-36,40,49-50,53-54H,4-7,12,14-16,18-25H2,1-3H3,(H,43,51)(H,44,55)(H,59,60)(H,61,62)(H2,42,45,46)(H2,56,57,58)/p-4/b10-9+,11-8-,17-13-/t28-,29-,30?,34?,35?,36?,40+/m1/s1
SMILESCCCCC/C=C\C[C@@H](O)CC/C=C/C=C\[C@@H](O)CCCC(=O)SCCNC(=O)CCNC(=O)C(O)C(C)(C)COP(=O)([O-])OP(=O)([O-])OCC1O[C@H](n2cnc3c(N)ncnc32)C(O)C1OP(=O)([O-])[O-]
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Similar chemical compounds in external resources
IdentifierDescription
bigg.metabolite:CE5969
biggM:CE5969
10,11-dihydro-LTB4-CoA
biggM:M_CE5969 secondary/obsolete/fantasy identifier