Grundinformationen
- Standard-SMILES
CC1=C(/C=C/C(C)=C/C=C/C(C)=C/C=C/C=C(C)/C=C/C=C(C)/C=C/C2=C(C)C(=O)CCC2(C)C)C(C)(C)CCC1=O- InChIKey
FDSDTBUPSURDBL-DKLMTRRASA-N- Summenformel
- C40H52O2
- Durchschnittliche Molmasse
- 564,8 g/mol
- Monoisotopische Masse
- 564,3967309
Überblick
Canthaxanthin is a carotenone that consists of beta,beta-carotene bearing two oxo substituents at positions 4 and 4'. It has a role as a biological pigment, a fungal metabolite, an Escherichia coli metabolite and a food colouring. It derives from a hydride of a beta-carotene.
Namen und Bezeichner
- Bevorzugter Name
- Canthaxanthin
- IUPAC
- 2,4,4-trimethyl-3-[(1E,3E,5E,7E,9E,11E,13E,15E,17E)-3,7,12,16-tetramethyl-18-(2,6,6-trimethyl-3-oxocyclohexen-1-yl)octadeca-1,3,5,7,9,11,13,15,17-nonaenyl]cyclohex-2-en-1-one
- Lokaler Name
- Canthaxanthin
- Englischer Name
- Canthaxanthin
- Summenformel
- C40H52O2
- Molmasse
- 564.85
Namen und Synonyme
Canthaxanthin514-78-3CanthaxanthineOrobronzeCarophyll RedFood orange 8Roxanthin Red 104,4'-Dioxo-beta-caroteneDTXSID0022727CI 40850KANTAKISANTIN4C3C6403MU
Weitere Namen anzeigen
cantaxanthincarophyllredE 161 GROXANTHINl-orange7AphanicinEuglenanone
NSC-374110INS NO.161GCHEBI:3362DTXCID002727INS-161GE-161GCI-(1975)NO.408502,4,4-trimethyl-3-[(1E,3E,5E,7E,9E,11E,13E,15E,17E)-3,7,12,16-tetramethyl-18-(2,6,6-trimethyl-3-oxocyclohexen-1-yl)octadeca-1,3,5,7,9,11,13,15,17-nonaenyl]cyclohex-2-en-1-one
Datenbank-Bezeichner
- CAS
514-78-3- PubChem CID
- 5281227
- DTXSID
DTXSID0022727- ChEMBL
CHEMBL1329004- ChEBI
CHEBI:3362- UNII
- 4C3C6403MU
- EC Number
- 208-187-2
- Nikkaji
- J6.290A
Eigenschaften
Berechnete Struktureigenschaften
- XLogP
- 11,4
- Polarare Oberfläche (TPSA)
- 34,1 Ų
- H-Brücken-Donoren
- 0
- H-Brücken-Akzeptoren
- 2
- Frei drehbare Bindungen
- 10
- Schwere Atome
- 42
- Formalladung
- 0
- Komplexität
- 1.270
Experimentelle und physikochemische Eigenschaften
LipidsLipids -> Prenol Lipids [PR] -> Isoprenoids [PR01] -> C40 isoprenoids (tetraterpenes) [PR0107]
CosmeticsCosmetic colorant
SpringerMaterials PropertiesCrystal structure
Food Additives
Foods, Drugs -> FDA Regulatory Status of Color Additives
COLOR OR COLORING ADJUNCT -> FDA Substance added to food
Boiling Point717.00 °C. @ 760.00 mm Hg
Physical Description
Deep violet crystals or crystalline powder
Solid
Physikochemische Eigenschaften
- Schmelzpunkt
- 217 · 217~218℃
- Siedepunkt
- 717 · 717.0±40.0 °C(Predicted)
- Dichte
- 1.003 · 1.003±0.06 g/cm3(Predicted)
- storage temp.
- -20 °C · -20°C
- Löslichkeit
- Chloroform (Slightly)
- Aggregatzustand
- Solid
- Farbe
- Very Dark Red to Black
- Biologische Quelle
- synthetic
- Merck
- 13 · 13,1758
- BRN
- 1898520 · 1898520
- Stabilität
- Light Sensitive
- Major Application
- food and beverages
- Kosmetik-Inhaltsstoffe Funktionen
- COLORANT
- InChIKey
- FDSDTBUPSURDBL-DKLMTRRASA-N
- SMILES
- CC(=C/C=C/C=C(C)/C=C/C=C(C)/C=C/C1=C(C)C(=O)CCC1(C)C)\C=C\C=C(C)\C=C\C2=C(C)C(=O)CCC2(C)C
- LogP
- 9.526 · 9.526 (est)
- CAS Datenbank
- 514 · 514-78-3(CAS DataBase Reference)
Sicherheit und Regulatorisches
GHS-Klassifizierung
GHS Classification
This chemical does not meet GHS hazard criteria for 99.1% (110 of 111) of all reports.
Not Classified
Aggregated GHS information provided per 111 reports by companies from 3 notifications to the ECHA C&L Inventory.
Gefahrenhinweise
Regulatory Information
Chemical: .beta.,.beta.-Carotene-4,4'-dione
Regulation (EC) No 1831/2003 (amended)
.beta.,.beta.-Carotene-4,4'-dione: Does not have an individual approval but may be used under an appropriate group standard
Hazard Classes and CategoriesNot Classified
Sicherheitsdaten
- wgk
- nwg
- RTECS-Nr.
- FI0330000
- Speicherklasse
- 11 - Combustible Solids
Chemie und Industrie
Pharmakologische Informationen
MeSH Pharmacological ClassificationNaturally occurring or synthetic substances that inhibit or retard oxidation reactions. They counteract the damaging effects of oxidation in animal tissues.
Tissue LocationsEpidermis
Cellular LocationsExtracellular
Verwendung und Herstellung
Use Classification
Food additives
Food Additives -> COLOUR -> JECFA Functional Classes
Food Additives -> COLOUR -> JECFA Functional Classes
Cosmetics -> Cosmetic colorant
Anwendungen
VerwendenCanthaxanthin is a synthetic red colorant that is the carotenoid of most intense red color. it is available in oil-soluble, oil-dispersible, and water-dispersible forms. it has fair ph, heat, light, and chemical stability with a low tinctorial strength. unlike the carotenoids beta- carotene and beta-apo-8-carotenal, it does not possess vitamin a activity. maximum usage level is 66 ppm. uses include carbonated soft drinks, salad dressing, and spaghetti sauce.
Vor- und nachgelagerte Produkte
Vorgelagerte Rohstoffe
Anbieter50 Anbieter
上海阿拉丁生化科技股份有限公司400-6206333 13167063860 · [email protected]
Shandong chuangyingchemical Co., Ltd.18853181302 · [email protected]
武汉鹏垒生物科技有限公司15871464247 · [email protected]
成都彼样生物科技有限公司18108052721 · [email protected]
合肥翰刚医药科技有限公司+8618062405514 · [email protected]
河北创之源生物科技有限公司13012111162
Hong Kong Tiansheng New Material Trading Co., Ltd+8617320695765 · [email protected]
湖北金梭生物科技有限公司00123456789 · [email protected]
郑州裕和食品添加剂有限公司0371-56060979 13838386843
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陕西帕尼尔生物科技有限公司029-84385017-8007 17602929471
Baoji Guokang Healthchem co.,ltd+8615604608665 15604608665 · [email protected]
Dayang Chem (Hangzhou) Co.,Ltd.+86-0571-88938639 17705817739 · [email protected]
Hangzhou Verychem Science And Technology Co.Ltd+86-86-57188162785 +8613606544505 · [email protected]
湖北辰心化工有限公司18696113233 · [email protected]
江西瑞威尔生物科技有限公司18502762009 · [email protected]
安耐吉化学&3A（安徽泽升科技有限公司）021-58432009 400-005-6266 · [email protected]
梯希爱（上海）化工贸易有限公司021-61109150 · [email protected]
湖北魏氏化学试剂股份有限公司027-59102966 18717199209 · [email protected]
成都普思生物科技股份有限公司028-85370565-229 18080489829 · [email protected]
MedChemexpress LLC021-58955995 · [email protected]
湖北广奥生物科技有限公司027-02702759223056 18162699093 · [email protected]
长沙上禾生物科技有限公司0731-84213302 18975842720 · [email protected]
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西安康诺化工有限公司029-86107037-8009 13279399072
ChemeGen 中国18818260767 · [email protected]
HONG KONG IPURE BIOLOGY CO.,LIMITED86 18062405514 18062405514 · [email protected]
四川库利南科技有限公司400-1166-196 18981987031 · [email protected]
Xiamen AmoyChem Co., Ltd+86-86-5926051114 · [email protected]
斯百全化学（上海）有限公司021-021-021-67601398-809-809-809 15221380277 · [email protected]
武汉普洛夫生物科技有限公司17612776928 · [email protected]
南京生利德生物科技有限公司025-57798810 18652991625 · [email protected]
上海敏寒医药科技有限公司17612188245 · [email protected]
上海陶素生化科技有限公司021-33632979 · [email protected]
湖北鑫源顺医药化工有限公司13971561712, 13995564702, 027-50664929 · [email protected]
天津阿尔塔科技有限公司022-65378550-8551 · [email protected]
成都零六生物科技有限公司400-1166-196 13458535857 · [email protected]
天津普西唐生物医药科技有限公司010-60605840 · [email protected]
上海麦克林生化科技股份有限公司15221275939 15221275939 · [email protected]
陕西缔都医药化工有限公司+86-29-87569262 +86-15003564040 · [email protected]
湖北巨胜科技有限公司027-59599241 18871490274 · [email protected]
池州凯隆进出口贸易有限公司[email protected]
Sigma-Aldrich西格玛奥德里奇(上海)贸易有限公司021-61415566 800-8193336 · [email protected]
深圳振强药物研发有限公司+86-0755-66853366 +86-13670046396 · [email protected]
ALB Technology Limited702-983-3769 · [email protected]
天津阿尔塔科技有限公司022-6537-8550 15522853686 · [email protected]
西安康诺化工有限公司029-86107037 15829389671 · [email protected]
TargetMol中国（陶术生物）021-021-33632979 15002134094 · [email protected]
Ergänzende Hinweise
DefinitionChEBI: A carotenone that consists of beta,beta-carotene bearing two oxo substituents at positions 4 and 4'.
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