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Chemistry, part 2

Content language

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Concept information

organooxygen compound > carbohydrates and carbohydrate derivatives > carbohydrate derivative > c-glycosyl compound > embigenin 2''-(2'''-acetylrhamnoside)
... > organooxygen compound > carbohydrates and carbohydrate derivatives > carbohydrate derivative > glycosyl compound > c-glycosyl compound > embigenin 2''-(2'''-acetylrhamnoside)
... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > carbon group molecular entity > organic molecular entity > flavonoids > embigenin 2''-(2'''-acetylrhamnoside)

Preferred term

embigenin 2''-(2'''-acetylrhamnoside)  

Type

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

Broader concept

charge

  • 0

formula

  • C31H36O15

inchi

  • InChI=1S/C31H36O15/c1-12-23(35)26(38)30(43-13(2)33)31(42-12)46-29-27(39)24(36)20(11-32)45-28(29)22-18(41-4)10-19-21(25(22)37)16(34)9-17(44-19)14-5-7-15(40-3)8-6-14/h5-10,12,20,23-24,26-32,35-39H,11H2,1-4H3/t12?,20?,23-,24+,26-,27-,28-,29?,30?,31-/m0/s1

inchikey

  • ZSQIFROPCHIGKD-BZFVIYJCSA-N

mass

  • 648.614

monoisotopicmass

  • 648.20542

smiles

  • O(C1[C@@H](O)[C@H](O)C(O[C@]1(C=2C(O)=C3C(OC(=CC3=O)C4=CC=C(OC)C=C4)=CC2OC)[H])CO)[C@@H]5OC([C@H](O)[C@H](O)C5OC(=O)C)C

subset

  • 2_STAR

synonym EXACT

  • [(2S,4S,5R)-2-[(2S,4S,5S)-4,5-dihydroxy-2-[5-hydroxy-7-methoxy-2-(4-methoxyphenyl)-4-oxochromen-6-yl]-6-(hydroxymethyl)oxan-3-yl]oxy-4,5-dihydroxy-6-methyloxan-3-yl] acetate

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:168515

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