Primary Record
Neohesperidin
- In stock
- 5,814 g
- Purity
- 98.9 %
- CAS
- 13241-33-3
Compound Identifiers & Properties
- CAS
- 13241-33-3
- PubChem CID
- 24721685
- SMILES
- C[C@H]1[C@@H]([C@H]([C@H]([C@@H](O1)O[C@@H]2[C@H]([C@@H]([C@H](O[C@H]2OC3=CC(=C4C(=O)C[C@H](OC4=C3)C5=CC(=CC(=C5)OC)O)O)CO)O)O)O)O)O
- Canonical SMILES
- COc1cc(O)cc([C@@H]2CC(=O)c3c(O)cc(O[C@@H]4O[C@H](CO)[C@@H](O)[C@H](O)[C@H]4O[C@@H]4O[C@@H](C)[C@H](O)[C@@H](O)[C@H]4O)cc3O2)c1
Names & Synonyms
- Neohesperidin
- Neohesperdin
- hesperetin 7-O-neohesperoside
- CHEMBL4303218
- SCHEMBL23079150
- SCHEMBL29484154
- MFCD16661259
- NSC 31048
- s2332
- ZINC49538626
- AKOS022168203
- CCG-270225
- EBD2197811
- 13241-33-3
- 241N333
- BRD-K96299080-001-02-7
- (S)-7-(((2S,3R,4S,5S,6R)-4,5-dihydroxy-6-(hydroxymethyl)-3-(((2S,3R,4R,5R,6S)-3,4,5-trihydroxy-6-methyltetrahydro-2H-pyran-2-yl)oxy)tetrahydro-2H-pyran-2-yl)oxy)-5-hydroxy-2-(3-hydroxy-5-methoxyphenyl)chroman-4-one