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Concept information

organooxygen compound > ether > aromatic ether > acrovestone > 7-o-methyltectorigenin 4'-o-gentiobioside
... > organooxygen compound > carbonyl compound > ketone > methyl ketone > acetophenones > acrovestone > 7-o-methyltectorigenin 4'-o-gentiobioside
... > organooxygen compound > carbonyl compound > ketone > aromatic ketone > acetophenones > acrovestone > 7-o-methyltectorigenin 4'-o-gentiobioside
... > organooxygen compound > oxacycle > benzopyran > 1-benzopyran > isoflavonoid > 7-o-methyltectorigenin 4'-o-gentiobioside

Preferred term

7-o-methyltectorigenin 4'-o-gentiobioside  

Type

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

Broader concept

charge

  • 0

formula

  • C29H34O16

inchi

  • InChI=1S/C29H34O16/c1-39-15-7-14-18(22(34)27(15)40-2)19(31)13(9-41-14)11-3-5-12(6-4-11)43-29-26(38)24(36)21(33)17(45-29)10-42-28-25(37)23(35)20(32)16(8-30)44-28/h3-7,9,16-17,20-21,23-26,28-30,32-38H,8,10H2,1-2H3/t16?,17?,20-,21+,23+,24?,25?,26?,28-,29+/m1/s1

inchikey

  • GEVYZCAPWHGAOB-OAZCAZALSA-N

mass

  • 638.575

monoisotopicmass

  • 638.18469

smiles

  • O1C([C@H](O)C(O)C(O)[C@H]1OC2=CC=C(C=C2)C=3C(=O)C=4C(OC3)=CC(OC)=C(OC)C4O)CO[C@@H]5OC([C@@H](O)[C@H](O)C5O)CO

subset

  • 2_STAR

synonym EXACT

  • 5-hydroxy-6,7-dimethoxy-3-[4-[(2R,5R)-3,4,5-trihydroxy-6-[[(2R,4S,5S)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxymethyl]oxan-2-yl]oxyphenyl]chromen-4-one

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:193277

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