Naringin dihydrochalcone

HCID 9894584
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Grundinformationen

CAS
18916-17-1
Standard-SMILES
C[C@@H]1O[C@@H](O[C@H]2[C@H](Oc3cc(O)c(C(=O)CCc4ccc(O)cc4)c(O)c3)O[C@H](CO)[C@@H](O)[C@@H]2O)[C@H](O)[C@H](O)[C@H]1O
InChIKey
CWBZAESOUBENAP-QVNVHUMTSA-N
Summenformel
C27H34O14
Durchschnittliche Molmasse
582,5 g/mol
Monoisotopische Masse
582,19485575

Namen und Bezeichner

Bevorzugter Name
Naringin dihydrochalcone
IUPAC
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-(4-hydroxyphenyl)propan-1-one
Englischer Name
Naringin dihydrochalcone
Summenformel
C27H34O14
Molmasse
582.56

Namen und Synonyme

naringin dihydrochalcone18916-17-1FEMA no. 44957233QDO0QWDTXSID10940428Phloretin, 4'-(2-O-alpha-L-rhamno-beta-D-glucopyranoside)1-Propanone, 1-(4-((2-O-(6-deoxy-alpha-L-mannopyranosyl)-beta-D-glucopyranosyl)oxy)-2,6-dihydroxyphenyl)-3-(4-hydroxyphenyl)-1-Propanone, 1-[4-[[2-O-(6-deoxy-alpha-L-mannopyranosyl)-beta-D-glucopyranosyl]oxy]-2,6-dihydroxyphenyl]-3-(4-hydroxyphenyl)-Glucopyranoside, 3,5-dihydroxy-4-(p-hydroxyhydrocinnamoyl)phenyl 2-O-(6-deoxy-alpha-L-mannopyranosyl)-, beta-D-RefChem:164854DTXCID401777781700-320-7
Weitere Namen anzeigen
Naringine DCSenior saccharinNaringin dihydrochalNARINGINDIHYDROHALCONENAGINGINDIHYDROCHALCONENARINGIN DIHYDOROCHALCONENaringin dihydrochalcone-RMranosyl)- β-D-glucopyranosyl]oxy]-
Naringin DC1-(4-(((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)-2,6-dihydroxyphenyl)-3-(4-hydroxyphenyl)propan-1-oneMFCD084361451-[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-(4-hydroxyphenyl)propan-1-oneNaringindihydrochalconeUNII-7233QDO0QWbeta-D-3,5-Dihydroxy-4-(p-hydroxyhydrocinnamoyl)phenyl 2-O-(6-deoxy-alpha-L-mannopyranosyl)glucopyranoside; Phloretin, 4'-(2-O-alpha-L-rhamno-beta-D-glucopyranoside); Naringin Dihydrochalconenaringin-dihydrochalcone

Datenbank-Bezeichner

CAS
18916-17-1
PubChem CID
9894584
DTXSID
DTXSID10940428
ChEMBL
CHEMBL5308388
ChEBI
CHEBI:184078
UNII
7233QDO0QW
EC Number
700-320-7
Nikkaji
J531.268J

Eigenschaften

Berechnete Struktureigenschaften

XLogP
-0,3
Polarare Oberfläche (TPSA)
236 Ų
H-Brücken-Donoren
9
H-Brücken-Akzeptoren
14
Frei drehbare Bindungen
9
Schwere Atome
41

Experimentelle und physikochemische Eigenschaften

Solubility · 2 Einträge

Soluble

Soluble (in ethanol)

Physical DescriptionWhite solid, Bland aroma

Physikochemische Eigenschaften

Schmelzpunkt
131 · 131-132°C
Siedepunkt
916.8 · 916.8±65.0 °C(Predicted)
Dichte
1.63 · 1.63±0.1 g/cm3(Predicted)
Dampfdruck
0 Pa · 0Pa at 20-50℃
FEMA
4495 · 4495 | NARINGIN DIHYDROCHALCONE
storage temp.
2 · under inert gas (nitrogen or Argon) at 2-8°C

Sicherheit und Regulatorisches

GHS-Klassifizierung

GHS Classification · 2 Einträge

Not Classified；Reported as not meeting GHS hazard criteria by 100 of 112 companies

Aggregated GHS information provided per 112 reports by companies from 3 notifications to the ECHA C&L Inventory.；Reported as not meeting GHS hazard criteria per 100 of 112 reports by companies.；There are 2 notifications provided by 12 of 112 reports by companies with hazard statement code(s).；Information may vary between notifications depending on impurities, additives, and other factors. The percentage value in parenthesis indicates the notified classification ratio from companies that provide hazard codes. Only hazard codes with percentage values above 10% are shown. For more detailed information, please visit ECHA C&L website.

Gefahrenhinweise

Regulatory Information · 2 Einträge

Commission Regulation (EC) No 1565/2000 (Repealed by Com. Implementing Reg. (EU) No 872/2012)

Status: Active Update: 24-10-2014 https://echa.europa.eu/registration-dossier/-/registered-dossier/11444

Hazard Classes and CategoriesNot Classified

Regulatorische Informationen

Regulatory Information · 2 Einträge

Commission Regulation (EC) No 1565/2000 (Repealed by Com. Implementing Reg. (EU) No 872/2012)

Status: Active Update: 24-10-2014 https://echa.europa.eu/registration-dossier/-/registered-dossier/11444

Sicherheitsdaten

wgk
WGK 1
hs_code
29329990
Speicherklasse
11 - Combustible Solids
Hazard Classifications
Acute Tox. 4 Oral

Chemie und Industrie

Verwendung und Herstellung

Use Classification · 3 Einträge

Flavouring Agent -> FLAVOURING_AGENT -> JECFA Functional Classes

Flavoring Agents -> JECFA Flavorings Index

Flavouring Agent -> FLAVOURING_AGENT -> JECFA Functional Classes

Anwendungen · 2 Einträge

BeschreibungNaringin dihydrochalcone is an artificial sweetener and flavonoid that has been isolated from various plants and has antioxidant activity. It scavenges ABTS (Item No. 27317), oxygen, and 2,2-diphenyl-1-picrylhydrazyl (DPPH; Item No. 14805) radicals in cell free assays (IC50s = 24, 322.8, and 318.9 μM, respectively).

VerwendenNaringin Dihydrochalcone is an intense sweetener and strong antioxidant compound which displays anti-allegeric activity.

Vor- und nachgelagerte Produkte

Anbieter100 Anbieter

北京华美互利生物化工010-56205725 · [email protected]
上海阿拉丁生化科技股份有限公司400-6206333 13167063860 · [email protected]
合肥翰刚医药科技有限公司+8618062405514 · [email protected]
陕西帕尼尔生物科技有限公司029-84385017; +8613259417953 · [email protected]
T&W GROUP021-61551611 13296011611 · [email protected]

Ergänzende Hinweise

DefinitionChEBI: Naringin dihydrochalcone is a member of flavonoids and a glycoside.

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