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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 > tetrahydroxy-dimethoxy-flavone (syringetin) p-coumaroyl-hexoside
... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > carbon group molecular entity > organic molecular entity > flavonoids > tetrahydroxy-dimethoxy-flavone (syringetin) p-coumaroyl-hexoside

Preferred term

tetrahydroxy-dimethoxy-flavone (syringetin) p-coumaroyl-hexoside  

Type

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

Broader concept

charge

  • 0

formula

  • C32H30O15

inchi

  • InChI=1S/C32H30O15/c1-42-20-9-15(10-21(43-2)25(20)38)29-31(26(39)24-18(36)11-17(35)12-19(24)44-29)47-32-28(41)27(40)30(22(13-33)45-32)46-23(37)8-5-14-3-6-16(34)7-4-14/h3-12,22,27-28,30,32-36,38,40-41H,13H2,1-2H3/b8-5+/t22-,27-,28-,30-,32+/m1/s1

inchikey

  • CNQFAVVHHRNBPP-ZOPOATFXSA-N

mass

  • 654.577

monoisotopicmass

  • 654.15847

smiles

  • O1[C@@H]([C@@H](OC(=O)/C=C/C2=CC=C(O)C=C2)[C@H](O)[C@@H](O)[C@@H]1OC3=C(OC=4C(C3=O)=C(O)C=C(O)C4)C5=CC(OC)=C(O)C(OC)=C5)CO

subset

  • 2_STAR

synonym EXACT

  • [(2R,3S,4R,5R,6S)-6-[5,7-dihydroxy-2-(4-hydroxy-3,5-dimethoxyphenyl)-4-oxochromen-3-yl]oxy-4,5-dihydroxy-2-(hydroxymethyl)oxan-3-yl] (E)-3-(4-hydroxyphenyl)prop-2-enoate

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:192522

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