Basic information
- CAS
14259-46-2- Standard SMILES
CC1OC(OCC2OC(Oc3cc(O)c4c(c3)OC(c3ccc(O)cc3)CC4=O)C(O)C(O)C2O)C(O)C(O)C1O- InChIKey
HXTFHSYLYXVTHC-UHFFFAOYSA-N- Molecular formula
- C27H32O14
- Average molar mass
- 580.5 g/mol
- Monoisotopic mass
- 580.17920569
Overview
Naringenin 7-rutinoside has been reported in Citrus paradisi, Cynara cardunculus, and Citrus maxima with data available.
Names & identifiers
- Preferred name
- Naringenin 7-rutinoside
- IUPAC
- 5-hydroxy-2-(4-hydroxyphenyl)-7-[3,4,5-trihydroxy-6-[(3,4,5-trihydroxy-6-methyloxan-2-yl)oxymethyl]oxan-2-yl]oxy-2,3-dihydrochromen-4-one
- English name
- NARIRUTIN
- Molecular formula
- C27H32O14
- Molecular weight
- 580.54
Names & synonyms
Naringenin 7-rutinosideRefChem:10922875-hydroxy-2-(4-hydroxyphenyl)-7-(3,4,5-trihydroxy-6-((3,4,5-trihydroxy-6-methyloxan-2-yl)oxymethyl)oxan-2-yl)oxy-2,3-dihydrochromen-4-oneNarirutin [M+H]+orb1222702CHEMBL3185240SCHEMBL26298383IEA81581s9242CCG-208408NCGC00163600-01DB-042637
Show more names
NARINGENIN-7-O-RUTINOSIDEISONARINGINIsonaringenin(2S)-NarirutinNARINGENIN-7-RUTINOSIDE(2S)-5-hydroxy-2-(4-hydroxyphenyl)-7-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-[[(2R,3R,4R,5R,6S)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxymethyl]oxan-2-yl]oxy-2,3-dihydrochromen-4-onerirutinNARIRUTINAids089292Aids-089292
Database identifiers
Properties
Computed structural properties
- XLogP
- -1.1
- Topological polar surface area
- 225 Ų
- Hydrogen bond donors
- 8
- Hydrogen bond acceptors
- 14
- Rotatable bonds
- 6
- Heavy atoms
- 41
- Formal charge
- 0
- Complexity
- 884
Experimental & physicochemical properties
Boiling Point924.00 to 925.00 °C. @ 760.00 mm Hg
Melting Point160 - 165 °C
Physical DescriptionSolid
Physicochemical properties
- Melting point
- 162 · 162-164°C
- Boiling point
- 924.3 · 924.3±65.0 °C(Predicted)
- Density
- 1.66 · 1.66±0.1 g/cm3(Predicted)
- FEMA
- 2769 · 2769 | NARINGEN EXTRACT (CITRUS PARADISI MACF.)
- storage temp.
- Sealed in dry,Room Temperature
- solubility
- DMSO, Methanol
- form
- Solid
- pka
- 7.18 · 7.18±0.40(Predicted)
- color
- Pale Yellow
- Odor
- bland
- Major Application
- metabolomicsvitamins, nutraceuticals, and natural products
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
Safety data
- wgk
- WGK 3
- hs_code
- 29389090
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- safety_code
- 22-24/25
- Storage Class
- 11 - Combustible Solids
- Hazard statements
- H302-H315-H319-H335
- Precautionary statements
- P261-P305+P351+P338
Chemistry & industry
Pharmacology
Cellular LocationsCytoplasm
Applications
Uses(2S)-Narirutin is a naturally occurring flavonoid that possess anti-allergic, anti-inflammatory, antiproliferative and anti-oxidant properties.
Suppliers100 total
北京华美互利生物化工010-56205725 · [email protected]
成都普瑞法科技开发有限公司+86-028-82633397 18982077548 · [email protected]
上海阿拉丁生化科技股份有限公司400-6206333 13167063860 · [email protected]
济南百隆化学有限公司[email protected] · [email protected]
南京普怡生物科技有限公司13814510036 · [email protected]
成都埃法生物科技有限公司028-028-85142057 19983342022 · [email protected]
成都彼样生物科技有限公司18108052721 · [email protected]
广州隽沐生物科技股份有限公司020-36607679; 13502246435 · [email protected]
成都市久鼎化学技术有限公司18584079237 · [email protected]
上海如吉生物科技发展有限公司+86-21-65211385-8001 36031160 · [email protected]
Hebei Yanxi Chemical Co., Ltd.
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…