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Chemistry, part 2

Content language

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Concept information

... > organooxygen compound > carbonyl compound > carboxylic acid > monocarboxylic acid > cyclitol carboxylic acid > quinic acid > butyl 3-o-caffeoylquinate
... > 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 > cyclitol carboxylic acid > quinic acid > butyl 3-o-caffeoylquinate
... > chemical entity > molecular entity > polyatomic entity > molecule > organic molecule > organic oxo compound > carbonyl compound > carboxylic acid > monocarboxylic acid > cyclitol carboxylic acid > quinic acid > butyl 3-o-caffeoylquinate
... > 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 > cyclitol carboxylic acid > quinic acid > butyl 3-o-caffeoylquinate
... > organooxygen compound > carbonyl compound > carboxylic acid > monocarboxylic acid > hydroxy monocarboxylic acid > cyclitol carboxylic acid > quinic acid > butyl 3-o-caffeoylquinate
... > 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 > hydroxy monocarboxylic acid > cyclitol carboxylic acid > quinic acid > butyl 3-o-caffeoylquinate
... > chemical entity > molecular entity > polyatomic entity > molecule > organic molecule > organic oxo compound > carbonyl compound > carboxylic acid > monocarboxylic acid > hydroxy monocarboxylic acid > cyclitol carboxylic acid > quinic acid > butyl 3-o-caffeoylquinate
... > 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 > hydroxy monocarboxylic acid > cyclitol carboxylic acid > quinic acid > butyl 3-o-caffeoylquinate
... > organooxygen compound > carbonyl compound > carboxylic acid > hydroxy carboxylic acid > hydroxy monocarboxylic acid > cyclitol carboxylic acid > quinic acid > butyl 3-o-caffeoylquinate
... > 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 > hydroxy carboxylic acid > hydroxy monocarboxylic acid > cyclitol carboxylic acid > quinic acid > butyl 3-o-caffeoylquinate
... > chemical entity > molecular entity > polyatomic entity > molecule > organic molecule > organic oxo compound > carbonyl compound > carboxylic acid > hydroxy carboxylic acid > hydroxy monocarboxylic acid > cyclitol carboxylic acid > quinic acid > butyl 3-o-caffeoylquinate
... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > carbon group molecular entity > organic molecular entity > organic acid > carboxylic acid > hydroxy carboxylic acid > hydroxy monocarboxylic acid > cyclitol carboxylic acid > quinic acid > butyl 3-o-caffeoylquinate
... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > carbon group molecular entity > organic molecular entity > organic hydroxy compound > hydroxy carboxylic acid > hydroxy monocarboxylic acid > cyclitol carboxylic acid > quinic acid > butyl 3-o-caffeoylquinate
... > chemical entity > molecular entity > polyatomic entity > heteroatomic molecular entity > hydroxides > organic hydroxy compound > hydroxy carboxylic acid > hydroxy monocarboxylic acid > cyclitol carboxylic acid > quinic acid > butyl 3-o-caffeoylquinate
... > chemical entity > molecular entity > polyatomic entity > molecule > cyclic compound > organic cyclic compound > carbocyclic compound > cyclitol carboxylic acid > quinic acid > butyl 3-o-caffeoylquinate
... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > carbon group molecular entity > organic molecular entity > organic molecule > organic cyclic compound > carbocyclic compound > cyclitol carboxylic acid > quinic acid > butyl 3-o-caffeoylquinate
... > chemical entity > molecular entity > polyatomic entity > molecule > organic molecule > organic cyclic compound > carbocyclic compound > cyclitol carboxylic acid > quinic acid > butyl 3-o-caffeoylquinate

Preferred term

butyl 3-o-caffeoylquinate  

Type

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

Broader concept

charge

  • 0

formula

  • C20H26O9

inchi

  • InChI=1S/C20H26O9/c1-2-3-8-28-19(26)20(27)10-15(23)18(25)16(11-20)29-17(24)7-5-12-4-6-13(21)14(22)9-12/h4-7,9,15-16,18,21-23,25,27H,2-3,8,10-11H2,1H3/b7-5-

inchikey

  • VNLREARKISTOAD-ALCCZGGFSA-N

mass

  • 410.419

monoisotopicmass

  • 410.15768

smiles

  • O(C1CC(O)(CC(O)C1O)C(OCCCC)=O)C(=O)/C=C/C2=CC(O)=C(O)C=C2

subset

  • 2_STAR

synonym EXACT

  • butyl 3-[(Z)-3-(3,4-dihydroxyphenyl)prop-2-enoyl]oxy-1,4,5-trihydroxycyclohexane-1-carboxylate

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:168635

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