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Concept information

Preferred term

دلفینیدین 3 گلوکوزید  

Type

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

charge

  • 0

formula

  • C21H21O12.Cl

inchi

  • InChI=1S/C21H20O12.ClH/c22-6-15-17(28)18(29)19(30)21(33-15)32-14-5-9-10(24)3-8(23)4-13(9)31-20(14)7-1-11(25)16(27)12(26)2-7;/h1-5,15,17-19,21-22,28-30H,6H2,(H4-,23,24,25,26,27);1H/t15-,17-,18+,19-,21-;/m1./s1

inchikey

  • ZJWIIMLSNZOCBP-BTTVDUMLSA-N

mass

  • 500.840

monoisotopicmass

  • 500.07215

smiles

  • [Cl-].O1[C@@H]([C@@H](O)[C@H](O)[C@@H](O)[C@@H]1OC=2C(=[O+]C=3C(C2)=C(O)C=C(O)C3)C4=CC(O)=C(O)C(O)=C4)CO

subset

  • 2_STAR

synonym EXACT

  • (2S,3R,4S,5S,6R)-2-[5,7-dihydroxy-2-(3,4,5-trihydroxyphenyl)chromenylium-3-yl]oxy-6-(hydroxymethyl)oxane-3,4,5-triol.chloride

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:189576

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