skip to main content

Content language

Contact us: CRM@email.irandoc.ac.ir

Concept information

Preferred term

cl(70:9)  

Type

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

Broader concept

charge

  • 0

formula

  • C85H138O17P2

inchi

  • InChI=1S/C85H138O17P2/c1-5-9-13-17-21-25-29-33-35-37-39-41-43-47-51-55-59-63-67-71-84(89)101-80(75-95-82(87)69-65-61-57-53-49-45-31-27-23-19-15-11-7-3)77-99-103(91,92)97-73-79(86)74-98-104(93,94)100-78-81(76-96-83(88)70-66-62-58-54-50-46-32-28-24-20-16-12-8-4)102-85(90)72-68-64-60-56-52-48-44-42-40-38-36-34-30-26-22-18-14-10-6-2/h9-10,13-14,21-22,25-28,31-36,39-42,47-48,51-52,59-60,63-64,79-81,86H,5-8,11-12,15-20,23-24,29-30,37-38,43-46,49-50,53-58,61-62,65-78H2,1-4H3,(H,91,92)(H,93,94)/b13-9-,14-10-,25-21-,26-22-,31-27-,32-28-,35-33-,36-34-,41-39-,42-40-,51-47-,52-48-,63-59-,64-60-/t80-,81-/m1/s1

inchikey

  • URZIYRIMSQBTBG-GOAOBQCESA-N

mass

  • 1493.970

monoisotopicmass

  • 1492.94093

smiles

  • P(OC[C@H](OC(=O)CC/C=C/C/C=C/C/C=C/C/C=C/C/C=C/C/C=C/CC)COC(=O)CCCCCCC/C=C/CCCCCC)(OCC(O)COP(OC[C@H](OC(=O)CC/C=C/C/C=C/C/C=C/C/C=C/C/C=C/C/C=C/CC)COC(=O)CCCCCCC/C=C/CCCCCC)(O)=O)(O)=O

subset

  • 2_STAR

synonym EXACT

  • [(2R)-1-[[3-[[(2R)-2-[(4Z,7Z,10Z,13Z,16Z,19Z)-docosa-4,7,10,13,16,19-hexaenoyl]oxy-3-[(Z)-hexadec-9-enoyl]oxypropoxy]-hydroxyphosphoryl]oxy-2-hydroxypropoxy]-hydroxyphosphoryl]oxy-3-[(Z)-hexadec-9-enoyl]oxypropan-2-yl] (4Z,7Z,10Z,13Z,16Z,19Z)-docosa-4,7,10,13,16,19-hexaenoate

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:189612

Download this concept: