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Chemistry, part 3

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Concept information

... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > carbon group molecular entity > organic molecular entity > pi(18:0/lte4)

Preferred term

pi(18:0/lte4)  

Type

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

Broader concept

charge

  • 0

formula

  • C50H88NO16PS

inchi

  • InChI=1S/C50H88NO16PS/c1-3-5-7-9-11-13-15-17-18-19-21-23-25-27-29-34-43(55)64-35-38(36-65-68(62,63)67-49-47(59)45(57)44(56)46(58)48(49)60)66-50(61)39(51)37-69-41(40(52)31-30-33-42(53)54)32-28-26-24-22-20-16-14-12-10-8-6-4-2/h12,14,20,22,24,26,28,32,38-41,44-49,52,56-60H,3-11,13,15-19,21,23,25,27,29-31,33-37,51H2,1-2H3,(H,53,54)(H,62,63)/b14-12-,22-20-,26-24+,32-28+/t38-,39+,40+,41-,44?,45-,46+,47-,48-,49?/m1/s1

inchikey

  • QQCIFSCEMPQOQH-URNSNXLYSA-N

mass

  • 1022.280

monoisotopicmass

  • 1021.55614

smiles

  • S(C[C@H](N)C(O[C@@H](COP(OC1[C@H](O)[C@H](O)C(O)[C@H](O)[C@H]1O)(O)=O)COC(=O)CCCCCCCCCCCCCCCCC)=O)[C@@H]([C@@H](O)CCCC(O)=O)/C=C/C=C/C=C/C/C=C/CCCCC

subset

  • 2_STAR

synonym EXACT

  • (5S,6R,7E,9E,11Z,14Z)-6-[(2R)-2-amino-3-[(2R)-1-[hydroxy-[(2R,3R,5S,6R)-2,3,4,5,6-pentahydroxycyclohexyl]oxyphosphoryl]oxy-3-octadecanoyloxypropan-2-yl]oxy-3-oxopropyl]sulanyl-5-hydroxyicosa-7,9,11,14-tetraenoic acid

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:230942

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