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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 > thromboxane > sm(d18:2(4e,14z)/txb2)

Preferred term

sm(d18:2(4e,14z)/txb2)  

Type

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

Broader concept

charge

  • 0

formula

  • C43H79N2O10P

inchi

  • InChI=1S/C43H79N2O10P/c1-6-8-10-11-12-13-14-15-16-17-18-19-24-28-39(47)38(35-54-56(51,52)53-33-32-45(3,4)5)44-42(49)29-25-21-20-23-27-37-40(48)34-43(50)55-41(37)31-30-36(46)26-22-9-7-2/h10-11,20,23-24,28,30-31,36-41,43,46-48,50H,6-9,12-19,21-22,25-27,29,32-35H2,1-5H3,(H-,44,49,51,52)/b11-10-,23-20-,28-24+,31-30+/t36-,37-,38-,39+,40-,41+,43?/m0/s1

inchikey

  • IWSYJJNDWNKMJD-WFPKBTJNSA-N

mass

  • 815.083

monoisotopicmass

  • 814.54723

smiles

  • P(OCC[N+](C)(C)C)(OC[C@H](NC(=O)CCC/C=C/C[C@H]1[C@@H](O)CC(O[C@@H]1/C=C/[C@@H](O)CCCCC)O)[C@H](O)/C=C/CCCCCCCC/C=C/CCC)([O-])=O

subset

  • 2_STAR

synonym EXACT

  • [(2S,3R,4E,14Z)-2-[[(Z)-7-[(2R,3S,4S)-4,6-dihydroxy-2-[(E,3S)-3-hydroxyoct-1-enyl]oxan-3-yl]hept-5-enoyl]amino]-3-hydroxyoctadeca-4,14-dienyl] 2-(trimethylazaniumyl)ethyl phosphate

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:231048

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