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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 > chalcogen molecular entity > oxygen molecular entity > organooxygen compound > carbonyl compound > 1,2,3-(8r,9r-epoxy-octadec-13z,15z-dien-4,6-diynoyl)-sn-glycerol
... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > chalcogen molecular entity > organochalcogen compound > organooxygen compound > carbonyl compound > 1,2,3-(8r,9r-epoxy-octadec-13z,15z-dien-4,6-diynoyl)-sn-glycerol
... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > carbon group molecular entity > organic molecular entity > heteroorganic entity > organochalcogen compound > organooxygen compound > carbonyl compound > 1,2,3-(8r,9r-epoxy-octadec-13z,15z-dien-4,6-diynoyl)-sn-glycerol
... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > carbon group molecular entity > organic molecular entity > organic molecule > organic oxo compound > carbonyl compound > 1,2,3-(8r,9r-epoxy-octadec-13z,15z-dien-4,6-diynoyl)-sn-glycerol
... > chemical entity > molecular entity > polyatomic entity > molecule > organic molecule > organic oxo compound > carbonyl compound > 1,2,3-(8r,9r-epoxy-octadec-13z,15z-dien-4,6-diynoyl)-sn-glycerol

Preferred term

1,2,3-(8r,9r-epoxy-octadec-13z,15z-dien-4,6-diynoyl)-sn-glycerol  

Type

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

Broader concept

charge

  • 0

formula

  • C56H66O9

inchi

  • InChI=1S/C56H66O9/c1-4-7-10-13-16-19-28-37-47-50(61-47)40-31-22-25-34-43-53(57)60-46-56(64-54(58)44-35-26-23-32-41-51-48(62-51)38-29-20-17-14-11-8-5-2)65-55(59)45-36-27-24-33-42-52-49(63-52)39-30-21-18-15-12-9-6-3/h7-18,47-52,56H,4-6,19-21,28-30,34-39,43-46H2,1-3H3/b10-7-,11-8-,12-9-,16-13-,17-14-,18-15-/t47-,48-,49-,50-,51-,52-/m1/s1

inchikey

  • KJSHRCSZEYAXHH-CGIRRWDMSA-N

mass

  • 883.135

monoisotopicmass

  • 882.47068

smiles

  • O1[C@@H]([C@H]1C#CC#CCCC(OC(OC(=O)CCC#CC#C[C@H]2O[C@@H]2CCC/C=C/C=C/CC)COC(=O)CCC#CC#C[C@H]3O[C@@H]3CCC/C=C/C=C/CC)=O)CCC/C=C/C=C/CC

subset

  • 2_STAR

synonym EXACT

  • 2,2-bis[7-[(2R,3R)-3-[(4Z,6Z)-nona-4,6-dienyl]oxiran-2-yl]hepta-4,6-diynoyloxy]ethyl 7-[(2R,3R)-3-[(4Z,6Z)-nona-4,6-dienyl]oxiran-2-yl]hepta-4,6-diynoate

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:186314

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