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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 2'-glucosyl-(1->4)-rhamnoside
... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > carbon group molecular entity > organic molecular entity > flavonoids > isoliquiritigenin 2'-glucosyl-(1->4)-rhamnoside

Preferred term

isoliquiritigenin 2'-glucosyl-(1->4)-rhamnoside  

Type

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

Broader concept

charge

  • 0

formula

  • C27H32O13

inchi

  • InChI=1S/C27H32O13/c1-12-25(40-27-23(35)21(33)20(32)19(11-28)39-27)22(34)24(36)26(37-12)38-18-10-15(30)7-8-16(18)17(31)9-4-13-2-5-14(29)6-3-13/h2-10,12,19-30,32-36H,11H2,1H3/b9-4+/t12?,19?,20-,21+,22-,23?,24?,25+,26+,27+/m1/s1

inchikey

  • PXGWOWJSMRNURR-IWAKXCNESA-N

mass

  • 564.540

monoisotopicmass

  • 564.18429

smiles

  • O([C@@H]1[C@H](O)C(O)[C@@H](OC1C)OC2=C(C=CC(O)=C2)C(=O)/C=C/C3=CC=C(O)C=C3)[C@@H]4OC([C@@H](O)[C@H](O)C4O)CO

subset

  • 2_STAR

synonym EXACT

  • (E)-1-[2-[(2S,4R,5R)-3,4-dihydroxy-6-methyl-5-[(2S,4S,5S)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyoxan-2-yl]oxy-4-hydroxyphenyl]-3-(4-hydroxyphenyl)prop-2-en-1-one

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:197171

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