skip to main content

Content language

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

Concept information

... > chemical entity > molecular entity > ion > anion > organic anion > organophosphate oxoanion > anionic phospholipid > 1-phosphatidyl-1d-myo-inositol 3,5-bisphosphate(5-) > 1,2-dioctanoyl-sn-glycero-3-phospho-(1d-myo-inositol-3,5-bisphosphate)(5-)

Preferred term

1,2-dioctanoyl-sn-glycero-3-phospho-(1d-myo-inositol-3,5-bisphosphate)(5-)  

Type

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

charge

  • -5

formula

  • C25H44O19P3

inchi

  • InChI=1S/C25H49O19P3/c1-3-5-7-9-11-13-18(26)39-15-17(41-19(27)14-12-10-8-6-4-2)16-40-47(37,38)44-25-21(29)23(42-45(31,32)33)20(28)24(22(25)30)43-46(34,35)36/h17,20-25,28-30H,3-16H2,1-2H3,(H,37,38)(H2,31,32,33)(H2,34,35,36)/p-5/t17-,20-,21-,22-,23-,24+,25-/m1/s1

inchikey

  • QXHVLVSULWMTCV-DICZBTHZSA-I

mass

  • 741.52950

monoisotopicmass

  • 741.17171

smiles

  • CCCCCCCC(=O)OC[C@H](COP([O-])(=O)O[C@H]1[C@H](O)[C@@H](OP([O-])([O-])=O)[C@H](O)[C@@H](OP([O-])([O-])=O)[C@H]1O)OC(=O)CCCCCCC

subset

  • 3_STAR

synonym EXACT

  • (2R)-2,3-bis(octanoyloxy)propyl (1S,2R,3R,5S,6R)-2,4,6-trihydroxy-3,5-bis(phosphonatooxy)cyclohexyl phosphate

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:85342

Download this concept: