CAS 20702-77-6PubChem CID 30231
Neohesperidin dihydrochalcone
Neohesperidin dihydrochalcone appears as off-white crystals or powder. Insoluble in water. (NTP, 1992)
— CAMEO Chemicals
- IUPAC name
- 1-[4-[(2S,3R,4S,5S,6R)-4,5-dihydroxy-6-(hydroxymethyl)-3-[(2S,3R,4R,5R,6S)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxyoxan-2-yl]oxy-2,6-dihydroxyphenyl]-3-(3-hydroxy-4-methoxyphenyl)propan-1-one
- Molecular formula
- C28H36O15
- Molecular weight
- 612.6 g/mol
- Exact mass
- 612.20542044 Da
- XLogP3
- -0.3
- Topological polar surface area
- 245.0 Ų
- Hydrogen-bond donors
- 9
- Hydrogen-bond acceptors
- 15
- Covalent units
- 1
- Defined stereocentres
- 10
Also known as
NhdcNeohesperidin dcNeohesperidin dhcNeohesperidine dihydrochalconeCitrosaneohesperidine DCNCI-C60764neohesperidin dihydrochalone
16 more reported names
3X476D83QVFEMA NO. 3811CHEBI:835351-Propanone, 1-[4-[[2-O-(6-deoxy-alpha-L-mannopyranosyl)-beta-D-glucopyranosyl]oxy]-2,6-dihydroxyphenyl]-3-(3-hydroxy-4-methoxyphenyl)-Glucopyranoside, 3,5-dihydroxy-4-(3-hydroxy-4-methoxyhydrocinnamoyl)phenyl 2-O-(6-deoxy-alpha-L-mannopyranosyl)-, beta-D-1-Propanone, 1-(4-((2-O-(6-deoxy-alpha-L-mannopyranosyl)-beta-D-glucopyranosyl)oxy)-2,6-dihydroxyphenyl)-3-(3-hydroxy-4-methoxyphenyl)-RefChem:832306243-978-6GLUCOPYRANOSIDE, 3,5-DIHYDROXY-4-(3-HYDROXY-4-METHOXYHYDROCINNAMOYL)PHENYL 2-O-ALPHA-L-RHAMNOPYRANOSYL-Neosperidin dihydrochalconeNeohesperidin-dihydrochalconeC28H36O151-(4-((2-O-(6-Deoxy-alpha-L-mannopyranosyl)-beta-D-glucopyranosyl)oxy)-2,6-dihydroxyphenyl)-3-(3-hydroxy-4-methoxyphenyl)propan-1-one3,5-dihydroxy-4-[3-(3-hydroxy-4-methoxyphenyl)propanoyl]phenyl 2-O-(6-deoxy-alpha-L-mannopyranosyl)-beta-D-glucopyranosideCCRIS 4848Neohesperidin dihydrochalcone hydrate
External database identifiers
Retrieved from NIH PubChem on 2026-08-31 by checksum-valid CAS matching. Chemical properties do not replace the regulatory decision on this page.