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Chemistry, part 1

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Concept information

... > chemical entity > molecular entity > ion > anion > organic anion > phenolate anion > 3''-dehydroisoorientin(1-)
... > chemical entity > molecular entity > ion > organic ion > organic anion > phenolate anion > 3''-dehydroisoorientin(1-)
... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > carbon group molecular entity > organic molecular entity > organic ion > organic anion > phenolate anion > 3''-dehydroisoorientin(1-)

Preferred term

3''-dehydroisoorientin(1-)  

Type

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

Broader concept

charge

  • -1

formula

  • C21H17O11

inchi

  • InChI=1S/C21H18O11/c22-6-14-17(27)19(29)20(30)21(32-14)16-11(26)5-13-15(18(16)28)10(25)4-12(31-13)7-1-2-8(23)9(24)3-7/h1-5,14,17,20-24,26-28,30H,6H2/p-1/t14-,17-,20-,21+/m1/s1

inchikey

  • RNSACPUPPGOAKB-NVGWVTIJSA-M

is_conjugate_acid_of

mass

  • 445.357

monoisotopicmass

  • 445.07763

smiles

  • C12=C(OC(=CC1=O)C3=CC(=C(C=C3)O)O)C=C(C(=C2O)[C@H]4[C@@H](C([C@@H]([C@H](O4)CO)O)=O)O)[O-]

subset

  • 2_STAR

synonym RELATED

  • 3''-dehydroisoorientin

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:194218

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