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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 > beta-(4-hydroxyphenyl)ethyl-3-o-e-caffeoyl-o-[beta-d-apiofuranosyl-(1->2)]-beta-d-glucopyranoside
... > 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 > beta-(4-hydroxyphenyl)ethyl-3-o-e-caffeoyl-o-[beta-d-apiofuranosyl-(1->2)]-beta-d-glucopyranoside
... > 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 > beta-(4-hydroxyphenyl)ethyl-3-o-e-caffeoyl-o-[beta-d-apiofuranosyl-(1->2)]-beta-d-glucopyranoside
... > 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 > beta-(4-hydroxyphenyl)ethyl-3-o-e-caffeoyl-o-[beta-d-apiofuranosyl-(1->2)]-beta-d-glucopyranoside
... > 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 > beta-(4-hydroxyphenyl)ethyl-3-o-e-caffeoyl-o-[beta-d-apiofuranosyl-(1->2)]-beta-d-glucopyranoside

Preferred term

beta-(4-hydroxyphenyl)ethyl-3-o-e-caffeoyl-o-[beta-d-apiofuranosyl-(1->2)]-beta-d-glucopyranoside  

Type

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

Broader concept

charge

  • 0

formula

  • C28H34O14

has_role

inchi

  • InChI=1S/C28H34O14/c29-12-20-22(35)23(41-21(34)8-4-16-3-7-18(32)19(33)11-16)24(42-27-25(36)28(37,13-30)14-39-27)26(40-20)38-10-9-15-1-5-17(31)6-2-15/h1-8,11,20,22-27,29-33,35-37H,9-10,12-14H2/b8-4+/t20-,22-,23+,24-,25+,26-,27+,28-/m1/s1

inchikey

  • RHQIZJFLMIOHRF-QNQOXIBFSA-N

mass

  • 594.56120

monoisotopicmass

  • 594.19486

smiles

  • [H][C@]1(OC[C@](O)(CO)[C@H]1O)O[C@H]1[C@H](OCCc2ccc(O)cc2)O[C@H](CO)[C@@H](O)[C@@H]1OC(=O)/C=C/c1ccc(O)c(O)c1

subset

  • 2_STAR

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:68344

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