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CHEBI:190691 - 6-(α-D-glucosaminyl)-(1-stearoyl,2-(9Z)-octadecenoyl-sn-glycero-3-phospho)-1D-myo-inositol zwitterion

ChEBI IDCHEBI:190691
ChEBI Name6-(α-D-glucosaminyl)-(1-stearoyl,2-(9Z)-octadecenoyl-sn-glycero-3-phospho)-1D-myo-inositol zwitterion
Stars
ASCII Name6-(alpha-D-glucosaminyl)-(1-stearoyl,2-(9Z)-octadecenoyl-sn-glycero-3-phospho)-1D-myo-inositol zwitterion
DefinitionA 6-(α-D-glucosaminyl)-1-phosphatidyl-1D-myo-inositol zwitterion arising from deprotonation of the phosphate OH group of 6-(α-D-glucosaminyl)-(1-stearoyl,2-(9Z)-octadecenoyl-sn-glycero-3-phospho)-1D-myo-inositol; major species at pH 7.3.
Last Modified6 April 2022
Submitternhn
DownloadsMolfile
FormulaC51H96NO17P
Net Charge0
Average Mass1026.293
Monoisotopic Mass1025.64159
SMILESCCCCCCCC/C=C\CCCCCCCC(=O)O[C@H](COC(=O)CCCCCCCCCCCCCCCCC)COP(=O)([O-])O[C@@H]1[C@H](O)[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]1[NH3+]
InChIInChI=1S/C51H96NO17P/c1-3-5-7-9-11-13-15-17-19-21-23-25-27-29-31-33-40(54)64-36-38(66-41(55)34-32-30-28-26-24-22-20-18-16-14-12-10-8-6-4-2)37-65-70(62,63)69-50-48(61)46(59)45(58)47(60)49(50)68-51-42(52)44(57)43(56)39(35-53)67-51/h18,20,38-39,42-51,53,56-61H,3-17,19,21-37,52H2,1-2H3,(H,62,63)/b20-18-/t38?,39-,42-,43-,44-,45-,46-,47+,48-,49-,50-,51-/m1/s1
InChIKeyJVSBGAUKBXMXFL-GIASWOKFSA-N
ChEBI Ontology
Outgoing Relation(s)
6-(α-D-glucosaminyl)-(1-stearoyl,2-(9Z)-octadecenoyl-sn-glycero-3-phospho)-1D-myo-inositol zwitterion (CHEBI:190691) is a 6-(α-D-glucosaminyl)-1-phosphatidyl-1D-myo-inositol zwitterion (CHEBI:57997)
UniProt Name  Source
6-(α-D-glucosaminyl)-(1-octadecanoyl,2-(9Z)-octadecenoyl-sn-glycero-3-phospho)-1D-myo-inositolUniProt
Citations