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

Concept information

Preferred term

trigoheteric acid methyl ester, (rel)-  

Type

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

Broader concept

charge

  • 0

formula

  • C19H26O3

has_role

inchi

  • InChI=1S/C19H26O3/c1-12(2)15-7-6-14-10-13(3)17(20)11-16(14)19(15,4)9-8-18(21)22-5/h10-11,15,20H,1,6-9H2,2-5H3/t15-,19-/m1/s1

inchikey

  • ZKQCHMDFCJRXNI-DNVCBOLYSA-N

mass

  • 302.40790

monoisotopicmass

  • 302.18819

smiles

  • [H][C@@]1(CCc2cc(C)c(O)cc2[C@]1(C)CCC(=O)OC)C(C)=C

subset

  • 2_STAR

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:69174

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