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PIM2

Properties

Image

Occurences in reactions

MNX_ID

MNXM107973

	#reac
in my sandbox	0
in MNXref (generic)	4
in models (compartimentalized)	4

formula

C₅₆H₁₀₅O₂₃P

charge

mass

1176.67843

reference

chebi:68562

InChIKey

WQFXOEJTASQGNX-XAXPYQTGSA-N

InChI

InChI=1S/C56H105O23P/c1-4-6-8-10-12-13-14-15-16-17-18-23-27-31-41(59)72-35-38(74-42(60)32-28-24-20-19-22-26-30-37(3)29-25-21-11-9-7-5-2)36-73-80(70,71)79-54-52(77-55-50(68)45(63)43(61)39(33-57)75-55)48(66)47(65)49(67)53(54)78-56-51(69)46(64)44(62)40(34-58)76-56/h37-40,43-58,61-69H,4-36H2,1-3H3,(H,70,71)/t37?,38?,39-,40-,43-,44-,45+,46+,47-,48-,49+,50+,51+,52-,53-,54-,55-,56-/m1/s1

SMILES

CCCCCCCCCCCCCCCC(=O)OCC(COP(=O)(O)O[C@H]1[C@H](O[C@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@@H]2O)[C@@H](O)[C@H](O)[C@@H](O)[C@H]1O[C@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@@H]1O)OC(=O)CCCCCCCCC(C)CCCCCCCC

Parent-child relations graph

Deprecated MNXref IDs graph

Similar chemical compounds in external resources
Identifier	Description
CHEBI:68562 chebi:68562	PIM2 1-O-(1-O-palmitoyl-2-O-tuberculostearoylglycero-3-phosphono)-2,5-di-O-D-mannopyranosyl-1-alpha-D-myo-inositol 1-[(hydroxy{[(2R,3R,5S,6R)-3,4,5-trihydroxy-2,6-bis(alpha-D-mannopyranosyloxy)cyclohexyl]oxy}phosphoryl)oxy]-3-(palmitoyloxy)propan-2-yl 10-methyloctadecanoate
bigg.metabolite:PIM2 biggM:PIM2	Phosphatidylinositol mannoside di-mannose (tuberculosis)
seed.compound:cpd15921 seedM:cpd15921	phosphatidylinositol mannoside di-mannose (tuberculosis) PIM2
biggM:M_PIM2 seedM:M_cpd15921	secondary/obsolete/fantasy identifier