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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 > (2s)-5,7,3',4'-tetrahydroxyflavanone 3'-(6-p-coumaroylglucoside)
... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > carbon group molecular entity > organic molecular entity > flavonoids > flavonoid > (2s)-5,7,3',4'-tetrahydroxyflavanone 3'-(6-p-coumaroylglucoside)

Preferred term

(2s)-5,7,3',4'-tetrahydroxyflavanone 3'-(6-p-coumaroylglucoside)  

Type

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

Broader concept

charge

  • 0

formula

  • C30H28O13

inchi

  • InChI=1S/C30H28O13/c31-16-5-1-14(2-6-16)3-8-25(36)40-13-24-27(37)28(38)29(39)30(43-24)42-22-9-15(4-7-18(22)33)21-12-20(35)26-19(34)10-17(32)11-23(26)41-21/h1-11,21,24,27-34,37-39H,12-13H2/b8-3+/t21-,24?,27+,28-,29?,30+/m0/s1

inchikey

  • BPWQQRVJKWQVQP-WXWPVEPQSA-N

mass

  • 596.541

monoisotopicmass

  • 596.15299

smiles

  • O1C([C@@H](O)[C@H](O)C(O)[C@@H]1OC=2C=C([C@H]3OC=4C(C(=O)C3)=C(O)C=C(O)C4)C=CC2O)COC(=O)/C=C/C5=CC=C(O)C=C5

subset

  • 2_STAR

synonym EXACT

  • [(3S,4S,6S)-6-[5-[(2S)-5,7-dihydroxy-4-oxo-2,3-dihydrochromen-2-yl]-2-hydroxyphenoxy]-3,4,5-trihydroxyoxan-2-yl]methyl (E)-3-(4-hydroxyphenyl)prop-2-enoate

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:168577

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