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Chemistry, part 1

Content language

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Concept information

... > organooxygen compound > carbohydrates and carbohydrate derivatives > carbohydrate derivative > glycosyl compound > glycoside > hexoside > glucoside > d-glucoside > beta-d-glucoside > cyanidin 3-o-(6-o-malonyl-beta-d-glucoside)
... > organooxygen compound > carbohydrates and carbohydrate derivatives > carbohydrate derivative > glycosyl compound > glycoside > anthocyanin cation > cyanidin 3-o-(6-o-malonyl-beta-d-glucoside)
... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > carbon group molecular entity > organic molecular entity > flavonoids > flavonoid > anthocyanin cation > cyanidin 3-o-(6-o-malonyl-beta-d-glucoside)
organooxygen compound > carbohydrates and carbohydrate derivatives > carbohydrate derivative > anthocyanin cation > cyanidin 3-o-(6-o-malonyl-beta-d-glucoside)

Preferred term

cyanidin 3-o-(6-o-malonyl-beta-d-glucoside)  

Type

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

Broader concept

charge

  • +1

formula

  • C24H23O14

has_functional_parent

inchi

  • InChI=1S/C24H22O14/c25-10-4-13(27)11-6-16(23(36-15(11)5-10)9-1-2-12(26)14(28)3-9)37-24-22(34)21(33)20(32)17(38-24)8-35-19(31)7-18(29)30/h1-6,17,20-22,24,32-34H,7-8H2,(H4-,25,26,27,28,29,30)/p+1/t17-,20-,21+,22-,24-/m1/s1

inchikey

  • ROQLTZUOXIQBDO-JZWLZXDTSA-O

mass

  • 535.43100

monoisotopicmass

  • 535.10823

smiles

  • O[C@@H]1[C@@H](COC(=O)CC(O)=O)O[C@@H](Oc2cc3c(O)cc(O)cc3[o+]c2-c2ccc(O)c(O)c2)[C@H](O)[C@H]1O

subset

  • 3_STAR

synonym EXACT

  • 2-(3,4-dihydroxyphenyl)-5,7-dihydroxychromenium-3-yl 6-O-(carboxyacetyl)-beta-D-glucopyranoside
  • Cyanidin 3-O-(6-O-malonyl-beta-D-glucoside)

synonym RELATED

  • Cyanidin-3-(6'-malonylglucoside)
  • Cyanidin 3-O-(6'-O-malonylglucoside)

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:31442

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