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Concept information

... > organooxygen compound > oxacycle > benzopyran > 1-benzopyran > isoflavonoid > 8-c-glucopyranosylgenistein 6''-o-apioside

Preferred term

8-c-glucopyranosylgenistein 6''-o-apioside  

Type

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

charge

  • 0

formula

  • C26H28O14

inchi

  • InChI=1S/C26H28O14/c27-8-26(36)9-39-25(24(26)35)38-7-15-19(32)20(33)21(34)23(40-15)17-14(30)5-13(29)16-18(31)12(6-37-22(16)17)10-1-3-11(28)4-2-10/h1-6,15,19-21,23-25,27-30,32-36H,7-9H2/t15-,19-,20+,21-,23+,24+,25-,26-/m1/s1

inchikey

  • HLCONXCNZYLRRC-VODXPUHMSA-N

mass

  • 564.496

monoisotopicmass

  • 564.14791

smiles

  • O1[C@@H]([C@@H](O)[C@H](O)[C@@H](O)[C@@]1(C=2C=3OC=C(C(=O)C3C(O)=CC2O)C4=CC=C(O)C=C4)[H])CO[C@@H]5OC[C@@](O)([C@H]5O)CO

subset

  • 2_STAR

synonym EXACT

  • 8-[(2S,3R,4R,5S,6R)-6-[[(2R,3R,4R)-3,4-dihydroxy-4-(hydroxymethyl)oxolan-2-yl]oxymethyl]-3,4,5-trihydroxyoxan-2-yl]-5,7-dihydroxy-3-(4-hydroxyphenyl)chromen-4-one

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:186741

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