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Concept information

... > organooxygen compound > oxacycle > benzopyran > 2-benzopyran > isochromanes > dihydroisocoumarins > hydrangenol 8-o-beta-d-glucopyranoside

Preferred term

hydrangenol 8-o-beta-d-glucopyranoside  

Type

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

charge

  • 0

formula

  • C21H22O9

has_functional_parent

inchi

  • InChI=1S/C21H22O9/c22-9-15-17(24)18(25)19(26)21(30-15)29-13-3-1-2-11-8-14(28-20(27)16(11)13)10-4-6-12(23)7-5-10/h1-7,14-15,17-19,21-26H,8-9H2/t14?,15-,17-,18+,19-,21-/m1/s1

inchikey

  • IKTPWMTZNXOEIV-VRKGAULQSA-N

mass

  • 418.39400

monoisotopicmass

  • 418.12638

smiles

  • OC[C@H]1O[C@@H](Oc2cccc3CC(OC(=O)c23)c2ccc(O)cc2)[C@H](O)[C@@H](O)[C@@H]1O

subset

  • 3_STAR

synonym EXACT

  • 3-(4-hydroxyphenyl)-1-oxo-3,4-dihydro-1H-isochromen-8-yl beta-D-glucopyranoside

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:68133

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