Feedback

Pentaglutamyl folate (THF)

PropertiesImageOccurences in reactions
MNX_IDMNXM3687Image of MNXM3687
#reac
in my sandbox 0
in MNXref (generic)6
in models (compartimentalized) 14
formulaC39H50N11O18
charge-1
mass960.87764
referencebiggM:5thf
InChIKeyKOKHBTUTPWMWQI-WYJPSZIUSA-M
InChIInChI=1S/C39H51N11O18/c40-20(33(59)60)5-9-24(51)19(13-27(54)55)39(25(52)10-6-21(41)34(61)62,37(67)68-28(56)12-8-23(43)36(65)66)50(26(53)11-7-22(42)35(63)64)32(58)16-1-3-17(4-2-16)45-14-18-15-46-30-29(47-18)31(57)49-38(44)48-30/h1-4,18-23,45,47H,5-15,40-43H2,(H,54,55)(H,59,60)(H,61,62)(H,63,64)(H,65,66)(H4,44,46,48,49,57)/p-1/t18?,19?,20?,21?,22?,23?,39-/m0/s1
SMILESNc1nc(O)c2NC(CNc3ccc(cc3)C(=O)N(C(=O)CCC([NH3+])C([O-])=O)[C@@](C(CC([O-])=O)C(=O)CCC([NH3+])C([O-])=O)(C(=O)CCC([NH3+])C([O-])=O)C(=O)OC(=O)CCC([NH3+])C([O-])=O)CNc2n1
Parent-child relations graph
Deprecated MNXref IDs graph
Similar chemical compounds in external resources
IdentifierDescription
bigg.metabolite:5thf
biggM:5thf
Pentaglutamyl folate (THF)
biggM:M_5thf secondary/obsolete/fantasy identifier