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Concept information

Preferred term

1،2 دیوکتانویل sn گلیسررو 3 فسفو (1 بعدی میو اینوزیتول 4 فسفات)  

Type

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

charge

  • 0

formula

  • C25H48O16P2

inchi

  • InChI=1S/C25H48O16P2/c1-3-5-7-9-11-13-18(26)37-15-17(39-19(27)14-12-10-8-6-4-2)16-38-43(35,36)41-25-22(30)20(28)24(21(29)23(25)31)40-42(32,33)34/h17,20-25,28-31H,3-16H2,1-2H3,(H,35,36)(H2,32,33,34)/t17-,20-,21+,22-,23-,24+,25+/m1/s1

inchikey

  • SNIQYSSXZJPPEL-LKTRINTESA-N

mass

  • 666.591

monoisotopicmass

  • 666.24176

smiles

  • [C@@H]1([C@@H]([C@@H]([C@@H]([C@H]([C@@H]1O)OP(O)(=O)O)O)O)OP(OC[C@@H](COC(=O)CCCCCCC)OC(=O)CCCCCCC)(=O)O)O

subset

  • 3_STAR

synonym EXACT

  • (2R)-3-[(hydroxy{[(1R,2R,3R,4R,5S,6R)-2,3,5,6-tetrahydroxy-4-(phosphonooxy)cyclohexyl]oxy}phosphoryl)oxy]propane-1,2-diyl dioctanoate

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:85900

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