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Concept information

Preferred term

4-hydroxymethyl-2-methoxyphenyl-1-o-beta-d-apiofuranosyl-(1->6)-o-beta-d-glucopyranoside  

Type

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

Broader concept

charge

  • 0

formula

  • C19H28O12

has_role

inchi

  • InChI=1S/C19H28O12/c1-27-11-4-9(5-20)2-3-10(11)30-17-15(24)14(23)13(22)12(31-17)6-28-18-16(25)19(26,7-21)8-29-18/h2-4,12-18,20-26H,5-8H2,1H3/t12-,13-,14+,15-,16+,17-,18-,19-/m1/s1

inchikey

  • CROSCHPQOAEYSN-OTCFHACESA-N

mass

  • 448.41840

monoisotopicmass

  • 448.15808

smiles

  • COc1cc(CO)ccc1O[C@@H]1O[C@H](CO[C@@H]2OC[C@](O)(CO)[C@H]2O)[C@@H](O)[C@H](O)[C@H]1O

subset

  • 2_STAR

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:68964

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