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Concept information

Preferred term

لوتئولین رامنوزید گلوکورونید  

Type

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

charge

  • 0

formula

  • C27H28O16

inchi

  • InChI=1S/C27H28O16/c1-8-18(31)19(32)22(35)26(39-8)42-14-3-2-9(4-11(14)28)15-7-13(30)17-12(29)5-10(6-16(17)41-15)40-27-23(36)20(33)21(34)24(43-27)25(37)38/h2-8,18-24,26-29,31-36H,1H3,(H,37,38)/t8?,18-,19?,20-,21-,22-,23?,24?,26-,27+/m0/s1

inchikey

  • PYKXXYKNFWZUIX-FVEIQTJESA-N

mass

  • 608.505

monoisotopicmass

  • 608.13773

smiles

  • O1C([C@H](O)C(O)[C@H](O)[C@@H]1OC2=C(O)C=C(C=C2)C=3OC4=CC(O[C@@H]5OC([C@@H](O)[C@H](O)C5O)C(O)=O)=CC(O)=C4C(=O)C3)C

subset

  • 2_STAR

synonym EXACT

  • (3S,4S,6S)-3,4,5-trihydroxy-6-[5-hydroxy-2-[3-hydroxy-4-[(2S,3S,5R)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxyphenyl]-4-oxochromen-7-yl]oxyoxane-2-carboxylic acid

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:167536

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