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Concept information

Preferred term

PS PI  

Type

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

charge

  • 0

formula

  • C30H55O14P

inchi

  • InChI=1S/C30H55O14P/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-24(33)41-19-22(43-25(34)18-17-23(31)32)20-42-45(39,40)44-30-21(2)26(35)27(36)28(37)29(30)38/h21-22,26-30,35-38H,3-20H2,1-2H3,(H,31,32)(H,39,40)/t21?,22-,26?,27?,28-,29?,30+/m1/s1

inchikey

  • KFHHITRMMMWMJW-WUTZMLAESA-N

mass

  • 670.730

monoisotopicmass

  • 670.33294

smiles

  • P(O[C@H]1C(C(O)C(O)[C@@H](O)C1O)C)(OC[C@H](OC(=O)CCC(O)=O)COC(=O)CCCCCCCCCCCCCCC)(O)=O

subset

  • 2_STAR

synonym EXACT

  • 4-[(2R)-1-hexadecanoyloxy-3-[hydroxy-[(1S,3R)-2,3,4,5-tetrahydroxy-6-methylcyclohexyl]oxyphosphoryl]oxypropan-2-yl]oxy-4-oxobutanoic acid

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:184620

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