Search MNXref
SystemsX.ch
The Swiss Initiative in Systems Biology
 Feedback

Trans-docos-2-enoyl-CoA

MNXM97615 is deprecated and here replaced by MNXM741760
!!! Alternative mappings exist !!!
PropertiesImageOccurences in reactions
MNX_IDMNXM741760Image of MNXM741760
#reac
in my sandbox 0
in MNXref (generic)4
in models (compartimentalized) 7
formulaC43H72N7O17P3S
charge-4
mass1083.39402
referencebiggM:CE2242
InChIKeyKRTIFNFQCJTGMV-ULDZQISASA-J
InChIInChI=1S/C43H76N7O17P3S/c1-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-23-34(52)71-27-26-45-33(51)24-25-46-41(55)38(54)43(2,3)29-64-70(61,62)67-69(59,60)63-28-32-37(66-68(56,57)58)36(53)42(65-32)50-31-49-35-39(44)47-30-48-40(35)50/h22-23,30-32,36-38,42,53-54H,4-21,24-29H2,1-3H3,(H,45,51)(H,46,55)(H,59,60)(H,61,62)(H2,44,47,48)(H2,56,57,58)/p-4/b23-22+/t32?,36?,37?,38?,42-/m0/s1
SMILESCCCCCCCCCCCCCCCCCCC/C=C/C(=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-]
Parent-child relations graph
 Deprecated MNXref IDs graph
Similar chemical compounds in external resources
IdentifierDescription
bigg.metabolite:CE2242
biggM:CE2242 		Trans-docos-2-enoyl-CoA
biggM:M_CE2242 secondary/obsolete/fantasy identifier