This is version 4.2 of MetaNetX/MNXref
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CDPethanolamine

MNXM449 is deprecated and here replaced by MNXM1103456
!!! Alternative mappings exist !!!
PropertiesImageOccurences in reactions
MNX_IDMNXM1103456Image of MNXM1103456
#reac
in my sandbox 0
in MNXref (generic)128
in models (compartimentalized) 18
formulaC11H19N4O11P2
charge-1
mass445.236442
referencebiggM:cdpea
InChIKeyWVIMUEUQJFPNDK-XCWAXFADSA-M
InChIInChI=1S/C11H20N4O11P2/c12-2-4-23-27(19,20)26-28(21,22)24-5-6-8(16)9(17)10(25-6)15-3-1-7(13)14-11(15)18/h1,3,6,8-10,16-17H,2,4-5,12H2,(H,19,20)(H,21,22)(H2,13,14,18)/p-1/t6-,8+,9-,10-/m1/s1
SMILESNc1ccn([C@@H]2O[C@H](COP([O-])(=O)OP([O-])(=O)OCC[NH3+])[C@H](O)[C@H]2O)c(=O)n1
Parent-child relations graph
Deprecated MNXref IDs graph
Similar chemical compounds in external resources
IdentifierDescription
bigg.metabolite:cdpea
biggM:cdpea
CDPethanolamine
biggM:M_cdpea secondary/obsolete/fantasy identifier