skip to main content

Chemistry, part 2

Content language

Contact us: CRM@email.irandoc.ac.ir

Concept information

... > organooxygen compound > carbohydrates and carbohydrate derivatives > carbohydrate derivative > glycosyl compound > glycoside > quercetin 3-(2'''-galloylglucosyl)-(1->2)-alpha-l-arabinofuranoside
... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > carbon group molecular entity > organic molecular entity > flavonoids > quercetin 3-(2'''-galloylglucosyl)-(1->2)-alpha-l-arabinofuranoside

Preferred term

quercetin 3-(2'''-galloylglucosyl)-(1->2)-alpha-l-arabinofuranoside  

Type

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

Broader concept

charge

  • 0

formula

  • C33H32O20

inchi

  • InChI=1S/C33H32O20/c34-8-19-23(43)26(46)30(51-31(47)11-4-16(40)22(42)17(41)5-11)33(49-19)53-29-24(44)20(9-35)50-32(29)52-28-25(45)21-15(39)6-12(36)7-18(21)48-27(28)10-1-2-13(37)14(38)3-10/h1-7,19-20,23-24,26,29-30,32-44,46H,8-9H2/t19?,20-,23-,24?,26+,29+,30?,32+,33+/m1/s1

inchikey

  • JPICQHQVPWZCIW-ZNFLAGFDSA-N

mass

  • 748.599

monoisotopicmass

  • 748.14869

smiles

  • O([C@H]1C(O)[C@H](O[C@H]1OC2=C(OC=3C(C2=O)=C(O)C=C(O)C3)C4=CC(O)=C(O)C=C4)CO)[C@@H]5OC([C@@H](O)[C@H](O)C5OC(=O)C6=CC(O)=C(O)C(O)=C6)CO

subset

  • 2_STAR

synonym EXACT

  • [(2S,4S,5S)-2-[(2S,3S,5R)-2-[2-(3,4-dihydroxyphenyl)-5,7-dihydroxy-4-oxochromen-3-yl]oxy-4-hydroxy-5-(hydroxymethyl)oxolan-3-yl]oxy-4,5-dihydroxy-6-(hydroxymethyl)oxan-3-yl] 3,4,5-trihydroxybenzoate

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:192845

Download this concept:

RDF/XML TURTLE JSON-LD