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Concept information

Preferred term

oleoyl danshenxinkun a  

Type

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

charge

  • 0

formula

  • C36H48O5

has_functional_parent

has_role

inchi

  • InChI=1S/C36H48O5/c1-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-22-31(37)41-25-27(3)32-34(38)30-24-23-28-26(2)20-19-21-29(28)33(30)36(40)35(32)39/h11-12,19-21,23-24,27,39H,4-10,13-18,22,25H2,1-3H3/b12-11-

inchikey

  • CKCNLHQWTDJDRS-QXMHVHEDSA-N

mass

  • 560.76330

monoisotopicmass

  • 560.35017

smiles

  • CCCCCCCC/C=C/CCCCCCCC(=O)OCC(C)C1=C(O)C(=O)c2c(ccc3c(C)cccc23)C1=O

subset

  • 3_STAR

synonym EXACT

  • 2-(3-hydroxy-8-methyl-1,4-dioxo-1,4-dihydrophenanthren-2-yl)propyl (9Z)-octadec-9-enoate

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:66819

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