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Chemistry, part 2

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Concept information

... > chemical entity > molecular entity > polyatomic entity > molecule > cyclic compound > organic cyclic compound > organic aromatic compound > phenylpropanoid > cinnamate ester > quercetin 3-o-alpha-l-[6'''-p-coumaroyl-beta-d-glucopyranosyl-(1->2)-rhamnopyranoside]
... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > carbon group molecular entity > organic molecular entity > organic molecule > organic cyclic compound > organic aromatic compound > phenylpropanoid > cinnamate ester > quercetin 3-o-alpha-l-[6'''-p-coumaroyl-beta-d-glucopyranosyl-(1->2)-rhamnopyranoside]
... > chemical entity > molecular entity > polyatomic entity > molecule > organic molecule > organic cyclic compound > organic aromatic compound > phenylpropanoid > cinnamate ester > quercetin 3-o-alpha-l-[6'''-p-coumaroyl-beta-d-glucopyranosyl-(1->2)-rhamnopyranoside]
... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > carbon group molecular entity > organic molecular entity > olefinic compound > enoate ester > cinnamate ester > quercetin 3-o-alpha-l-[6'''-p-coumaroyl-beta-d-glucopyranosyl-(1->2)-rhamnopyranoside]
... > organooxygen compound > carbohydrates and carbohydrate derivatives > carbohydrate derivative > glycosyl compound > glycoside > glycosyloxyflavone > quercetin o-glycoside > quercetin o-glucoside > quercetin 3-o-alpha-l-[6'''-p-coumaroyl-beta-d-glucopyranosyl-(1->2)-rhamnopyranoside]
... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > carbon group molecular entity > organic molecular entity > flavonoids > flavonoid > flavones > glycosyloxyflavone > quercetin o-glycoside > quercetin o-glucoside > quercetin 3-o-alpha-l-[6'''-p-coumaroyl-beta-d-glucopyranosyl-(1->2)-rhamnopyranoside]
... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > carbon group molecular entity > organic molecular entity > flavonoids > flavonoid > anthoxanthin > flavones > glycosyloxyflavone > quercetin o-glycoside > quercetin o-glucoside > quercetin 3-o-alpha-l-[6'''-p-coumaroyl-beta-d-glucopyranosyl-(1->2)-rhamnopyranoside]

Preferred term

quercetin 3-o-alpha-l-[6'''-p-coumaroyl-beta-d-glucopyranosyl-(1->2)-rhamnopyranoside]  

Type

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

Broader concept

charge

  • 0

formula

  • C36H36O18

has_functional_parent

has_role

inchi

  • InChI=1S/C36H36O18/c1-14-26(43)30(47)34(54-35-31(48)29(46)27(44)23(52-35)13-49-24(42)9-4-15-2-6-17(37)7-3-15)36(50-14)53-33-28(45)25-21(41)11-18(38)12-22(25)51-32(33)16-5-8-19(39)20(40)10-16/h2-12,14,23,26-27,29-31,34-41,43-44,46-48H,13H2,1H3/b9-4+/t14-,23+,26-,27+,29-,30+,31+,34+,35-,36-/m0/s1

inchikey

  • LSMKTLJKBSXMMR-WLKGHKDFSA-N

mass

  • 756.666

monoisotopicmass

  • 756.19016

smiles

  • O([C@@H]1O[C@@H]([C@H]([C@@H]([C@H]1O)O)O)COC(=O)/C=C/C2=CC=C(C=C2)O)[C@H]3[C@@H](O[C@H]([C@@H]([C@H]3O)O)C)OC=4C(C5=C(C=C(C=C5OC4C6=CC(=C(C=C6)O)O)O)O)=O

subset

  • 3_STAR

synonym EXACT

  • 2-(3,4-dihydroxyphenyl)-5,7-dihydroxy-4-oxo-4H-chromen-3-yl 6-deoxy-2-O-{6-O-[(2E)-3-(4-hydroxyphenyl)prop-2-enoyl]-beta-D-glucopyranosyl}-alpha-L-mannopyranoside

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:66285

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