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Chemistry, part 2

Content language

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Concept information

... > organooxygen compound > carbonyl compound > carboxylic acid > monocarboxylic acid > alpha,beta-unsaturated monocarboxylic acid > cinnamic acids > hydroxycinnamic acid > 2-/{[(2e)-3-(3,4-dihydroxyphenyl)prop-2-enoyl]oxy/}-3-[4-hydroxy-3-(sulfooxy)phenyl]propanoic acid
... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > carbon group molecular entity > organic molecular entity > organic molecule > organic oxo compound > carbonyl compound > carboxylic acid > monocarboxylic acid > alpha,beta-unsaturated monocarboxylic acid > cinnamic acids > hydroxycinnamic acid > 2-/{[(2e)-3-(3,4-dihydroxyphenyl)prop-2-enoyl]oxy/}-3-[4-hydroxy-3-(sulfooxy)phenyl]propanoic acid
... > chemical entity > molecular entity > polyatomic entity > molecule > organic molecule > organic oxo compound > carbonyl compound > carboxylic acid > monocarboxylic acid > alpha,beta-unsaturated monocarboxylic acid > cinnamic acids > hydroxycinnamic acid > 2-/{[(2e)-3-(3,4-dihydroxyphenyl)prop-2-enoyl]oxy/}-3-[4-hydroxy-3-(sulfooxy)phenyl]propanoic acid
... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > carbon group molecular entity > organic molecular entity > organic acid > carboxylic acid > monocarboxylic acid > alpha,beta-unsaturated monocarboxylic acid > cinnamic acids > hydroxycinnamic acid > 2-/{[(2e)-3-(3,4-dihydroxyphenyl)prop-2-enoyl]oxy/}-3-[4-hydroxy-3-(sulfooxy)phenyl]propanoic acid
... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > carbon group molecular entity > organic molecular entity > olefinic compound > cinnamic acids > hydroxycinnamic acid > 2-/{[(2e)-3-(3,4-dihydroxyphenyl)prop-2-enoyl]oxy/}-3-[4-hydroxy-3-(sulfooxy)phenyl]propanoic acid

Preferred term

2-/{[(2e)-3-(3,4-dihydroxyphenyl)prop-2-enoyl]oxy/}-3-[4-hydroxy-3-(sulfooxy)phenyl]propanoic acid  

Type

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

Broader concept

charge

  • 0

formula

  • C18H16O11S

inchi

  • InChI=1S/C18H16O11S/c19-12-4-1-10(7-14(12)21)3-6-17(22)28-16(18(23)24)9-11-2-5-13(20)15(8-11)29-30(25,26)27/h1-8,16,19-21H,9H2,(H,23,24)(H,25,26,27)/b6-3+

inchikey

  • UBKQDFBKGWYEBD-ZZXKWVIFSA-N

mass

  • 440.380

monoisotopicmass

  • 440.04133

smiles

  • S(OC=1C=C(CC(OC(=O)/C=C/C2=CC(O)=C(O)C=C2)C(O)=O)C=CC1O)(O)(=O)=O

subset

  • 2_STAR

synonym EXACT

  • 2-[(E)-3-(3,4-dihydroxyphenyl)prop-2-enoyl]oxy-3-(4-hydroxy-3-sulooxyphenyl)propanoic acid

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:169038

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