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Concept information

Preferred term

6-(alpha-d-glucosaminyl)-(1-stearoyl,2-(9z)-octadecenoyl-sn-glycero-3-phospho)-1d-myo-inositol zwitterion  

Type

  • http://www.irandoc.ac.ir/onto/irandoc-meta/Concept

charge

  • 0

formula

  • C51H96NO17P

inchi

  • InChI=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

inchikey

  • JVSBGAUKBXMXFL-GIASWOKFSA-N

mass

  • 1026.293

monoisotopicmass

  • 1025.64159

smiles

  • O=P([O-])(O[C@@H]1[C@@H]([C@@H]([C@H]([C@@H]([C@H]1O[C@H]2O[C@@H]([C@H]([C@@H]([C@H]2[NH3+])O)O)CO)O)O)O)O)OCC(COC(CCCCCCCCCCCCCCCCC)=O)OC(=O)CCCCCCC/C=C/CCCCCCCC

subset

  • 2_STAR

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:190691

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