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

Concept information

Preferred term

tungtungmadic acid  

Type

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

Broader concept

charge

  • 0

formula

  • C25H26O12

has_role

inchi

  • InChI=1S/C25H26O12/c26-15-5-1-13(9-17(15)28)3-7-21(31)36-20-12-25(35,24(33)34)11-19(30)23(20)37-22(32)8-4-14-2-6-16(27)18(29)10-14/h1-3,5-7,9-10,19-20,23,26-30,35H,4,8,11-12H2,(H,33,34)/b7-3+

inchikey

  • WPEARBZAFBYHRG-XVNBXDOJSA-N

mass

  • 518.46670

monoisotopicmass

  • 518.14243

smiles

  • OC1CC(O)(CC(OC(=O)/C=C/c2ccc(O)c(O)c2)C1OC(=O)CCc1ccc(O)c(O)c1)C(O)=O

subset

  • 2_STAR

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:66280

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