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Chemistry, part 2

Content language

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Concept information

... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > carbon group molecular entity > organic molecular entity > lipid > fatty acid derivative > icosanoid > prostanoid > ps(20:5(5z,8z,11z,14z,17z)/pgf1alpha)

Preferred term

ps(20:5(5z,8z,11z,14z,17z)/pgf1alpha)  

Type

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

Broader concept

charge

  • 0

formula

  • C46H76NO13P

inchi

  • InChI=1S/C46H76NO13P/c1-3-5-7-8-9-10-11-12-13-14-15-16-17-18-19-20-25-29-44(51)57-34-38(35-58-61(55,56)59-36-41(47)46(53)54)60-45(52)30-26-22-21-24-28-39-40(43(50)33-42(39)49)32-31-37(48)27-23-6-4-2/h5,7,9-10,12-13,15-16,18-19,31-32,37-43,48-50H,3-4,6,8,11,14,17,20-30,33-36,47H2,1-2H3,(H,53,54)(H,55,56)/b7-5-,10-9-,13-12-,16-15-,19-18-,32-31+/t37-,38+,39+,40+,41-,42-,43+/m0/s1

inchikey

  • AHHWFHSPHAAING-BXCKMEFWSA-N

mass

  • 882.082

monoisotopicmass

  • 881.50543

smiles

  • P(OC[C@H](OC(=O)CCCCCC[C@@H]1[C@H]([C@H](O)C[C@@H]1O)/C=C/[C@@H](O)CCCCC)COC(=O)CCC/C=C/C/C=C/C/C=C/C/C=C/C/C=C/CC)(OC[C@H](N)C(O)=O)(O)=O

subset

  • 2_STAR

synonym EXACT

  • (2S)-2-amino-3-[[(2R)-2-[7-[(1R,2R,3R,5S)-3,5-dihydroxy-2-[(E,3S)-3-hydroxyoct-1-enyl]cyclopentyl]heptanoyloxy]-3-[(5Z,8Z,11Z,14Z,17Z)-icosa-5,8,11,14,17-pentaenoyl]oxypropoxy]-hydroxyphosphoryl]oxypropanoic acid

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:230042

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