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Concept information

Preferred term

Ins 1 P Cer(d20:0/30:0)(1)  

Type

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

charge

  • -1

formula

  • C56H111NO11P

inchi

  • InChI=1S/C56H112NO11P/c1-3-5-7-9-11-13-15-17-19-20-21-22-23-24-25-26-27-28-29-30-32-34-36-38-40-42-44-46-50(59)57-48(47-67-69(65,66)68-56-54(63)52(61)51(60)53(62)55(56)64)49(58)45-43-41-39-37-35-33-31-18-16-14-12-10-8-6-4-2/h48-49,51-56,58,60-64H,3-47H2,1-2H3,(H,57,59)(H,65,66)/p-1/t48-,49+,51-,52-,53+,54+,55+,56-/m0/s1

inchikey

  • RQMAVRPBPQCOQQ-LYNYOQRDSA-M

mass

  • 1005.45500

monoisotopicmass

  • 1004.79002

smiles

  • CCCCCCCCCCCCCCCCCCCCCCCCCCCCCC(=O)N[C@@H](COP([O-])(=O)O[C@H]1[C@H](O)[C@@H](O)[C@H](O)[C@@H](O)[C@H]1O)[C@H](O)CCCCCCCCCCCCCCCCC

subset

  • 3_STAR

synonym EXACT

  • (2S,3R)-3-hydroxy-2-(triacontanoylamino)icosyl (1S,2R,3R,4S,5S,6R)-2,3,4,5,6-pentahydroxycyclohexyl phosphate

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:72561

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