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Concept information

Preferred term

1,2-di-(9z,12z-octadecadienoyl)-3-(beta-d-galactosyl)-sn-glycerol  

Type

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

charge

  • 0

formula

  • C45H78O10

inchi

  • InChI=1S/C45H78O10/c1-3-5-7-9-11-13-15-17-19-21-23-25-27-29-31-33-40(47)52-36-38(37-53-45-44(51)43(50)42(49)39(35-46)55-45)54-41(48)34-32-30-28-26-24-22-20-18-16-14-12-10-8-6-4-2/h11-14,17-20,38-39,42-46,49-51H,3-10,15-16,21-37H2,1-2H3/b13-11-,14-12-,19-17-,20-18-/t38-,39-,42+,43+,44-,45-/m1/s1

inchikey

  • BROOMPUVDPTGEG-RHNBIRJRSA-N

mass

  • 779.097

monoisotopicmass

  • 778.55950

smiles

  • O(C[C@H](OC(CCCCCCC/C=C/C/C=C/CCCCC)=O)COC(CCCCCCC/C=C/C/C=C/CCCCC)=O)[C@H]1[C@@H]([C@H]([C@@H](O)[C@@H](CO)O1)O)O

subset

  • 3_STAR

synonym EXACT

  • (2S)-3-(beta-D-galactopyranosyloxy)propane-1,2-diyl (9Z,12Z,9'Z,12'Z)di-octadeca-9,12-dienoate

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:90506

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