Terminology Service for NFDI4Health
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oleoyl danshenxinkun A

Go to external page http://purl.obolibrary.org/obo/CHEBI_66819

A diterpenoid with a fatty acyl side chain isolated from Salvia miltiorrhiza and has been shown to inhibit platelet aggregation induced by arachidonic acid.

Term info

Label

oleoyl danshenxinkun A

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

3_STAR

IUPAC NAME
2-(3-hydroxy-8-methyl-1,4-dioxo-1,4-dihydrophenanthren-2-yl)propyl (9Z)-octadec-9-enoate [ IUPAC ]

charge

0

formula

C36H48O5

has obo namespace

chebi_ontology

id

CHEBI:66819

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