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Chemistry, part 3

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Concept information

... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > carbon group molecular entity > organic molecular entity > salicylic acyl beta-d-glucuronide (1-)

Preferred term

salicylic acyl beta-d-glucuronide (1-)  

Type

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

Broader concept

charge

  • -1

formula

  • C13H13O9

inchi

  • InChI=1S/C13H14O9/c14-6-4-2-1-3-5(6)12(20)22-13-9(17)7(15)8(16)10(21-13)11(18)19/h1-4,7-10,13-17H,(H,18,19)/p-1/t7-,8-,9+,10-,13-/m0/s1

inchikey

  • IXVVXKRKCLJCKA-UNLLLRGISA-M

mass

  • 313.239

monoisotopicmass

  • 313.05651

smiles

  • [C@@H]1(OC(=O)C=2C(=CC=CC2)O)O[C@H](C([O-])=O)[C@H]([C@@H]([C@H]1O)O)O

subset

  • 2_STAR

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:176960

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