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Concept information

Preferred term

Baicalin (1-)  

Type

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

charge

  • -1

formula

  • C21H17O11

inchi

  • InChI=1S/C21H18O11/c22-9-6-10(8-4-2-1-3-5-8)30-11-7-12(14(23)15(24)13(9)11)31-21-18(27)16(25)17(26)19(32-21)20(28)29/h1-7,16-19,21,23-27H,(H,28,29)/p-1/t16-,17-,18+,19-,21+/m0/s1

inchikey

  • IKIIZLYTISPENI-ZFORQUDYSA-M

is_conjugate_base_of

mass

  • 445.35310

monoisotopicmass

  • 445.07763

smiles

  • O[C@H]1[C@@H](O[C@@H]([C@@H](O)[C@@H]1O)C([O-])=O)Oc1cc2oc(cc(=O)c2c(O)c1O)-c1ccccc1

subset

  • 3_STAR

synonym EXACT

  • 5,6-dihydroxy-4-oxo-2-phenyl-4H-chromen-7-yl beta-D-glucopyranosiduronate

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:61283

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