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Concept information

Preferred term

OKODA PI  

Type

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

charge

  • 0

formula

  • C39H67O15P

inchi

  • InChI=1S/C39H67O15P/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-17-20-25-32(42)51-28-31(53-33(43)26-21-18-15-16-19-23-30(41)24-22-27-40)29-52-55(49,50)54-39-37(47)35(45)34(44)36(46)38(39)48/h9-10,22,24,27,31,34-39,44-48H,2-8,11-21,23,25-26,28-29H2,1H3,(H,49,50)/b10-9-,24-22+/t31-,34?,35-,36?,37?,38?,39?/m1/s1

inchikey

  • RRBQZUDFMTXZPR-DIKVSTQTSA-N

mass

  • 806.924

monoisotopicmass

  • 806.42176

smiles

  • P(OC1C(O)C(O)C(O)[C@@H](O)C1O)(OC[C@H](OC(=O)CCCCCCCC(=O)/C=C/C=O)COC(=O)CCCCCCC/C=C/CCCCCCCC)(O)=O

subset

  • 2_STAR

synonym EXACT

  • [(2R)-2-[(E)-9,12-dioxododec-10-enoyl]oxy-3-[hydroxy-[(5R)-2,3,4,5,6-pentahydroxycyclohexyl]oxyphosphoryl]oxypropyl] (Z)-octadec-9-enoate

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:186300

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