skip to main content

Content language

Contact us: CRM@email.irandoc.ac.ir

Concept information

... > chemical entity > molecular entity > polyatomic entity > heteroatomic molecular entity > hydroxides > organic hydroxy compound > phenols > benzenediols > catechols > 6'-coumaroyl-1'-o-[2-(3,4-dihydroxyphenyl)ethyl]-beta-d-glucopyranoside
... > chemical entity > molecular entity > polyatomic entity > molecule > cyclic compound > organic cyclic compound > organic aromatic compound > phenols > benzenediols > catechols > 6'-coumaroyl-1'-o-[2-(3,4-dihydroxyphenyl)ethyl]-beta-d-glucopyranoside
... > chemical entity > molecular entity > polyatomic entity > molecule > organic molecule > organic cyclic compound > organic aromatic compound > phenols > benzenediols > catechols > 6'-coumaroyl-1'-o-[2-(3,4-dihydroxyphenyl)ethyl]-beta-d-glucopyranoside
... > chemical entity > molecular entity > polyatomic entity > molecule > cyclic compound > organic cyclic compound > organic aromatic compound > phenylpropanoid > cinnamate ester > 6'-coumaroyl-1'-o-[2-(3,4-dihydroxyphenyl)ethyl]-beta-d-glucopyranoside
... > chemical entity > molecular entity > polyatomic entity > molecule > organic molecule > organic cyclic compound > organic aromatic compound > phenylpropanoid > cinnamate ester > 6'-coumaroyl-1'-o-[2-(3,4-dihydroxyphenyl)ethyl]-beta-d-glucopyranoside
... > chemical entity > molecular entity > polyatomic entity > heteroatomic molecular entity > hydroxides > organic hydroxy compound > phenols > polyphenol > 6'-coumaroyl-1'-o-[2-(3,4-dihydroxyphenyl)ethyl]-beta-d-glucopyranoside
... > chemical entity > molecular entity > polyatomic entity > molecule > cyclic compound > organic cyclic compound > organic aromatic compound > phenols > polyphenol > 6'-coumaroyl-1'-o-[2-(3,4-dihydroxyphenyl)ethyl]-beta-d-glucopyranoside
... > chemical entity > molecular entity > polyatomic entity > molecule > organic molecule > organic cyclic compound > organic aromatic compound > phenols > polyphenol > 6'-coumaroyl-1'-o-[2-(3,4-dihydroxyphenyl)ethyl]-beta-d-glucopyranoside

Preferred term

6'-coumaroyl-1'-o-[2-(3,4-dihydroxyphenyl)ethyl]-beta-d-glucopyranoside  

Type

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

charge

  • 0

formula

  • C23H26O10

has_functional_parent

inchi

  • InChI=1S/C23H26O10/c24-15-5-1-13(2-6-15)4-8-19(27)32-12-18-20(28)21(29)22(30)23(33-18)31-10-9-14-3-7-16(25)17(26)11-14/h1-8,11,18,20-26,28-30H,9-10,12H2/b8-4+/t18-,20-,21+,22-,23-/m1/s1

inchikey

  • DNMNWOHCZHSQAI-FZYQUXMESA-N

mass

  • 462.44650

monoisotopicmass

  • 462.15260

smiles

  • O[C@@H]1[C@@H](COC(=O)/C=C/c2ccc(O)cc2)O[C@@H](OCCc2ccc(O)c(O)c2)[C@H](O)[C@H]1O

subset

  • 3_STAR

synonym EXACT

  • 2-(3,4-dihydroxyphenyl)ethyl 6-O-[(2E)-3-(4-hydroxyphenyl)prop-2-enoyl]-beta-D-glucopyranoside

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:65664

Download this concept: