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

Concept information

Preferred term

PKODiA PI  

Type

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

charge

  • 0

formula

  • C33H57O16P

inchi

  • InChI=1S/C33H57O16P/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-17-26(37)46-21-24(48-27(38)18-15-16-23(34)19-20-25(35)36)22-47-50(44,45)49-33-31(42)29(40)28(39)30(41)32(33)43/h19-20,24,28-33,39-43H,2-18,21-22H2,1H3,(H,35,36)(H,44,45)/b20-19+/t24-,28?,29-,30?,31?,32?,33?/m1/s1

inchikey

  • GXYNPAFQVDFTDK-CCBHMEMRSA-N

mass

  • 740.777

monoisotopicmass

  • 740.33842

smiles

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

subset

  • 2_STAR

synonym EXACT

  • (E)-8-[(2R)-1-hexadecanoyloxy-3-[hydroxy-[(5R)-2,3,4,5,6-pentahydroxycyclohexyl]oxyphosphoryl]oxypropan-2-yl]oxy-4,8-dioxooct-2-enoic acid

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:169430

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