(Q27130930)

hesperetin anion (English)

7 October 2016

chemical formula

C₁₆H₁₃O₆⁻

1 reference

based on heuristic

inferred from SMILES

canonical SMILES

COC1=C(C=C(C=C1)C2CC(=O)C3=C(O2)C=C(C=C3[O-])O)O

1 reference

hesperetin anion (English)

7 October 2016

isomeric SMILES

COC1=C(C=C(C=C1)[C@@H]2CC(=O)C3=C(O2)C=C(C=C3[O-])O)O

1 reference

hesperetin anion (English)

InChI=1S/C16H14O6/c1-21-13-3-2-8(4-10(13)18)14-7-12(20)16-11(19)5-9(17)6-15(16)22-14/h2-6,14,17-19H,7H2,1H3/p-1/t14-/m0/s1

7 October 2016

Identifiers

InChI

1 reference

hesperetin anion (English)

AIONOLUJZLIMTK-AWEZNQCLSA-M

7 October 2016

InChIKey

2 references

hesperetin anion (English)

7 October 2016

stated in

ChEBI release 2020-09-01

1 reference

(2S)-5-Hydroxy-2-(3-hydroxy-4-methoxyphenyl)-4-oxo-7-chromanolate (English)

7 October 2016

1 reference

hesperetin anion (English)

7 October 2016

ChEBI ID

61249

mapping relation type

1 reference