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Concept information

Preferred term

6'-o-cinnamoylmussaenosidic acid, (rel)-  

Type

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

Broader concept

charge

  • 0

formula

  • C25H30O11

has_role

inchi

  • InChI=1S/C25H30O11/c1-25(32)10-9-14-15(22(30)31)11-34-23(18(14)25)36-24-21(29)20(28)19(27)16(35-24)12-33-17(26)8-7-13-5-3-2-4-6-13/h2-8,11,14,16,18-21,23-24,27-29,32H,9-10,12H2,1H3,(H,30,31)/b8-7+/t14-,16+,18-,19+,20-,21+,23-,24-,25+/m0/s1

inchikey

  • YXCPQONSMLKCHP-ZRSLISBWSA-N

mass

  • 506.49910

monoisotopicmass

  • 506.17881

smiles

  • [H][C@]1(O[C@H](COC(=O)/C=C/c2ccccc2)[C@@H](O)[C@H](O)[C@H]1O)O[C@@H]1OC=C(C(O)=O)[C@]2([H])CC[C@@](C)(O)[C@]12[H]

subset

  • 2_STAR

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:67348

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