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Chemistry, part 2

Content language

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Concept information

... > organooxygen compound > carbohydrates and carbohydrate derivatives > carbohydrate derivative > glycosyl compound > glycoside > isoliquiritigenin 4,4'-diglucoside
... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > carbon group molecular entity > organic molecular entity > flavonoids > isoliquiritigenin 4,4'-diglucoside

Preferred term

isoliquiritigenin 4,4'-diglucoside  

Type

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

Broader concept

charge

  • 0

formula

  • C27H32O14

inchi

  • InChI=1S/C27H32O14/c28-10-18-20(32)22(34)24(36)26(40-18)38-13-4-1-12(2-5-13)3-8-16(30)15-7-6-14(9-17(15)31)39-27-25(37)23(35)21(33)19(11-29)41-27/h1-9,18-29,31-37H,10-11H2/b8-3+/t18-,19-,20-,21?,22-,23-,24-,25-,26-,27-/m1/s1

inchikey

  • JELPWVHINQKKQW-KBBRGJEVSA-N

mass

  • 580.539

monoisotopicmass

  • 580.17921

smiles

  • O1[C@@H](C(O)[C@@H](O)[C@@H](O)[C@@H]1OC2=CC(O)=C(C=C2)C(=O)/C=C/C3=CC=C(O[C@@H]4O[C@@H]([C@@H](O)[C@@H](O)[C@H]4O)CO)C=C3)CO

subset

  • 2_STAR

synonym EXACT

  • (E)-1-[2-hydroxy-4-[(2S,3R,4R,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyphenyl]-3-[4-[(2S,3R,4R,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyphenyl]prop-2-en-1-one

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:186485

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