skip to main content

Chemistry, part 3

Content language

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

Concept information

... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > carbon group molecular entity > organic molecular entity > sm(d17:1/20:5(5z,8z,11z,14z,16e)-oh(18r))

Preferred term

sm(d17:1/20:5(5z,8z,11z,14z,16e)-oh(18r))  

Type

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

Broader concept

charge

  • 0

formula

  • C42H75N2O7P

inchi

  • InChI=1S/C42H75N2O7P/c1-6-8-9-10-11-12-13-19-22-25-28-31-34-41(46)40(38-51-52(48,49)50-37-36-44(3,4)5)43-42(47)35-32-29-26-23-20-17-15-14-16-18-21-24-27-30-33-39(45)7-2/h15-18,23-24,26-27,30-31,33-34,39-41,45-46H,6-14,19-22,25,28-29,32,35-38H2,1-5H3,(H-,43,47,48,49)/b17-15-,18-16-,26-23-,27-24-,33-30+,34-31+/t39-,40+,41-/m1/s1

inchikey

  • CNSFJYSSXVPYAW-WBCOZXAFSA-N

mass

  • 751.043

monoisotopicmass

  • 750.53119

smiles

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

subset

  • 2_STAR

synonym EXACT

  • [(E,2S,3R)-3-hydroxy-2-[[(5Z,8Z,11Z,14Z,16E,18R)-18-hydroxyicosa-5,8,11,14,16-pentaenoyl]amino]heptadec-4-enyl] 2-(trimethylazaniumyl)ethyl phosphate

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:230962

Download this concept:

RDF/XML TURTLE JSON-LD