skip to main content

Content language

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

Concept information

Preferred term

okddia-ps  

Type

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

Broader concept

charge

  • 0

formula

  • C36H62NO13P

inchi

  • InChI=1S/C36H62NO13P/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-17-20-23-34(41)47-27-31(28-48-51(45,46)49-29-32(37)36(43)44)50-35(42)24-21-18-15-16-19-22-30(38)25-26-33(39)40/h9-10,25-26,31-32H,2-8,11-24,27-29,37H2,1H3,(H,39,40)(H,43,44)(H,45,46)/b10-9-,26-25+/t31-,32+/m1/s1

inchikey

  • WBWTWUZHYUOEGI-WUOSZTNESA-N

mass

  • 747.860

monoisotopicmass

  • 747.39588

smiles

  • P(OC[C@H](OC(=O)CCCCCCCC(=O)/C=C/C(O)=O)COC(=O)CCCCCCC/C=C/CCCCCCCC)(OC[C@H](N)C(O)=O)(O)=O

subset

  • 2_STAR

synonym EXACT

  • (E)-12-[(2R)-1-[[(2S)-2-amino-2-carboxyethoxy]-hydroxyphosphoryl]oxy-3-[(Z)-octadec-9-enoyl]oxypropan-2-yl]oxy-4,12-dioxododec-2-enoic acid

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:187278

Download this concept: