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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 > vitexin 6''-(3-hydroxy-3-methylglutarate)
... > organooxygen compound > carbohydrates and carbohydrate derivatives > carbohydrate derivative > glycosyl compound > c-glycosyl compound > vitexin 6''-(3-hydroxy-3-methylglutarate)
... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > carbon group molecular entity > organic molecular entity > flavonoids > vitexin 6''-(3-hydroxy-3-methylglutarate)

Preferred term

vitexin 6''-(3-hydroxy-3-methylglutarate)  

Type

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

Broader concept

charge

  • 0

formula

  • C27H28O14

inchi

  • InChI=1S/C27H28O14/c1-27(38,8-18(32)33)9-19(34)39-10-17-22(35)23(36)24(37)26(41-17)21-14(30)6-13(29)20-15(31)7-16(40-25(20)21)11-2-4-12(28)5-3-11/h2-7,17,22-24,26,28-30,35-38H,8-10H2,1H3,(H,32,33)/t17-,22+,23?,24?,26-,27?/m0/s1

inchikey

  • FUKCNWJCRSRWIJ-MGTFTROPSA-N

mass

  • 576.507

monoisotopicmass

  • 576.14791

smiles

  • O1[C@](C(O)C(O)[C@H](O)[C@@H]1COC(=O)CC(O)(CC(O)=O)C)(C=2C=3OC(=CC(=O)C3C(O)=CC2O)C4=CC=C(O)C=C4)[H]

subset

  • 2_STAR

synonym EXACT

  • 5-[[(2S,3S,6S)-6-[5,7-dihydroxy-2-(4-hydroxyphenyl)-4-oxochromen-8-yl]-3,4,5-trihydroxyoxan-2-yl]methoxy]-3-hydroxy-3-methyl-5-oxopentanoic acid

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:186024

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