Basic information
- CAS
126-29-4- Standard SMILES
CC(/C=C/C=C(C)/C=C/[C@@]12O[C@]1(C)C[C@@H](O)CC2(C)C)=C\C=C\C=C(C)\C=C\C=C(C)\C=C\[C@@]12O[C@]1(C)C[C@@H](O)CC2(C)C- InChIKey
SZCBXWMUOPQSOX-WVJDLNGLSA-N- Molecular formula
- C40H56O4
- Average molar mass
- 600.9 g/mol
- Monoisotopic mass
- 600.41786027
Overview
All-trans-violaxanthin is the all-trans-stereoisomer of violaxanthin. It has a role as a food colouring.
Names & identifiers
- Preferred name
- Violaxanthin
- IUPAC
- (1R,3S,6S)-6-[(1E,3E,5E,7E,9E,11E,13E,15E,17E)-18-[(1S,4S,6R)-4-hydroxy-2,2,6-trimethyl-7-oxabicyclo[4.1.0]heptan-1-yl]-3,7,12,16-tetramethyloctadeca-1,3,5,7,9,11,13,15,17-nonaenyl]-1,5,5-trimethyl-7-oxabicyclo[4.1.0]heptan-3-ol
- English name
- VIOLAXANTHIN
- Molecular formula
- C40H56O4
- Molecular weight
- 600.87
Names & synonyms
Violaxanthin126-29-4all-trans-ViolaxanthinZeaxanthin diepoxidetrans-ViolaxanthinCHEBI:35288E 161e(1R,3S,6S)-6-[(1E,3E,5E,7E,9E,11E,13E,15E,17E)-18-[(1S,4S,6R)-4-hydroxy-2,2,6-trimethyl-7-oxabicyclo[4.1.0]heptan-1-yl]-3,7,12,16-tetramethyloctadeca-1,3,5,7,9,11,13,15,17-nonaenyl]-1,5,5-trimethyl-7-oxabicyclo[4.1.0]heptan-3-ol51C926029ADTXSID9010169345,6:5',6'-Diepoxy-5,5',6,6'-tetrahydro-beta-carotene-3,3'-diol(3S,3'S,5R,5'R, 6S,6'S)-5,6:5',6'-Diepoxy-5,5',6,6'-tetrahydro-beta,beta-carotene-3,3'-diol
Show more names
Violaxanthin(AS)Violaxanthin[52444]Zeaxanthin Impurity 19VIOLAXANTHIN (In Solution)Violaxanthin(AS) (In Solution)Violaxanthin - solution in ethanol
(1R,3S,6S)-6-((1E,3E,5E,7E,9E,11E,13E,15E,17E)-18-((1S,4S,6R)-4-hydroxy-2,2,6-trimethyl-7-oxabicyclo(4.1.0)heptan-1-yl)-3,7,12,16-tetramethyloctadeca-1,3,5,7,9,11,13,15,17-nonaenyl)-1,5,5-trimethyl-7-oxabicyclo(4.1.0)heptan-3-olRefChem:194378CHEBI:27295DTXCID001475117Violoxanthin(3S,3'S,5R,5'R,6S,6'S)-5,5',6,6'-tetrahydro-5,6:5',6'-diepoxy-beta,beta-carotene-3,3'-diol(3S,5R,6S,3'S,5'R,6'S)-5,6,5',6'-DIEPOXY-5,6,5',6'- TETRAHYDRO-BETA,BETA-CAROTENE-3,3'-DIOL5a,6a:5'a,6'a-Bisoxy-5,5',6,6'-tetrahydro-b,b-carotene-3b,3b'-diol
Database identifiers
- CAS
126-29-4- PubChem CID
- 448438
- DTXSID
DTXSID901016934- ChEBI
CHEBI:35288- UNII
- 51C926029A
- Nikkaji
- J8.626F
Properties
Computed structural properties
- XLogP
- 9.8
- Topological polar surface area
- 65.5 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 10
- Heavy atoms
- 44
- Formal charge
- 0
- Complexity
- 1,270
Experimental & physicochemical properties
DrugsPharmaceuticals -> Listed in ZINC15
LipidsLipids -> Prenol Lipids [PR] -> Isoprenoids [PR01] -> C40 isoprenoids (tetraterpenes) [PR0107]
Melting Point208 °C
Physical DescriptionSolid
Physicochemical properties
- Melting point
- 200 ° · 200°
- alpha
- 20 Cd · 20Cd +35° (c = 0.08 in chloroform)
- Boiling point
- 570.8 °C · 570.8°C (rough estimate)
- Density
- 0.9826 · 0.9826 (rough estimate)
- refractive index
- 1.476 · 1.4760 (estimate)
- storage temp.
- -70 °C · -70°C
- solubility
- Chloroform, Ethyl Acetate
- form
- Orange Brown Soild
- pka
- 14.56 · 14.56±0.70(Predicted)
- λmax
- 438 · λ: 438-442 nm Amax
- BRN
- 101269 · 101269
- Major Application
- cleaning productscosmeticsfood and beveragespersonal care
- InChIKey
- SZCBXWMUOPQSOX-WVJDLNGLSA-N
- SMILES
- CC(/C=C/[C@@]12[C@](C)(O2)C[C@@H](O)CC1(C)C)=C\C=C\C(C)=C\C=C\C=C(C)\C=C\C=C(\C=C\[C@]34C(C)(C)C[C@H](O)C[C@]3(O4)C)C
- FDA UNII
- 51 C926029A · 51C926029A
- UNSPSC Code
- 12352202 · 12352202
- NACRES
- 32 · NA.32
- WGK Germany
- 3 · 3
- HS Code
- 29419090 · 29419090
- Storage Class
- 11 · 11 - Combustible Solids
Safety & regulation
Safety data
- wgk
- 3
- hs_code
- 29419090
- Storage Class
- 11 - Combustible Solids
Chemistry & industry
Pharmacology
Cellular LocationsExtracellular
Applications
Usestrans-Violaxanthin, is a Carotenoid dye. It is a natural xanthophyll pigment with an orange color found in a variety of plants including pansies. It is approved to be used as a food additive and food coloring.
UsesViolaxanthin has been used as a standard/control in high-pressure liquid chromatography (HPLC) analysis of pigment extracts to confirm the high-level astaxanthin accumulation suspected from the visual phenotype ofNt-AXT plants.
General DescriptionViolaxanthins are natural pigmented constituents or carotenoids present in most fruits and vegetables.
Upstream & downstream products
Upstream raw materials
Suppliers45 total
南京世洲生物科技有限公司025-85560043 15850508050 · [email protected]
上海惠诚生物科技有限公司60498804 18930850192 · [email protected]
成都乐美天医药科技有限公司17308096051 17308096051 · [email protected]
Career Henan Chemica Co+86-0371-86658258 +86-13203830695 · [email protected]
成都超九八生物科技有限公司13348960310 13348960310 · [email protected]
艾吉析科技（上海）有限公司17717235263 · [email protected]
上海纽雀客生物科技有限公司13916276291 · [email protected]
成都普睿法药物研发有限公司82633860 18982077548 · [email protected]
郑州鸿晟医药科技有限公司0371-55695890 15637198702 · [email protected]
上海赛可锐生物科技有限公司021-58000709 13120558703 · [email protected]
湖北丹鼎医药科技有限公司17701422019 17701422019 · [email protected]
湖北魏氏化学试剂股份有限公司027-59102966 18717199209 · [email protected]
广东方信生物科技有限公司0751-2838688 13376594225 · [email protected]
武汉丰泰威远科技有限公司+86-27-8746-5837 +86-18627785180 · [email protected]
武汉丰泰威远科技有限公司027-87465837 19945049750 · [email protected]
佛山宝诺生物科技有限公司0757-85921206 18520245316 · [email protected]
TargetMol 中国（陶术生物）400-821-0310 15002144251 · [email protected]
上海源叶生物科技有限公司13636370518 · [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]
上海谱科生物技术有限公司021-64705760 18027310741 · [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]
上海一研生物科技有限公司021-69985186 13611928337 · [email protected]
四川精萃天成药物科技有限公司028-87865381 18108190480 · [email protected]
安耐吉化学&3A（安徽泽升科技股份有限公司）400-0056266 · [email protected]
陕西缔都医药化工有限公司+86-29-81139210 +86-17392587031 · [email protected]
湖北扬信医药科技有限公司15374522761 · [email protected]
Shanghai Acmec Biochemical Technology Co., Ltd.+86-18621343501 · [email protected]
深圳聚合生化科技有限公司+86-400-002-6226 · [email protected]
成都普瑞法科技开发有限公司+86-28-82633860; +86-18080483897 · [email protected]
湖北信康医药化工有限公司027-027-59308705 18871579363 · [email protected]
TargetMol中国（陶术生物）4008200310 15002144251 · [email protected]
上海迈瑞尔生化科技有限公司18621169109 · [email protected]
SHANGHAI KEAN TECHNOLOGY CO., LTD.+8613817748580 · [email protected]
上海贝万塔生物科技有限公司021-67187366 19901745723 · [email protected]
上海莫奇生物科技有限公司13341702378 · [email protected]
湖北萃园生物科技有限公司18162795156 18162795156 · [email protected]
BOC Sciences+1-631-485-4226 · [email protected]
ChemeGen 中国18818260767 · [email protected]
上海同田生物技术有限公司021-51320588 · [email protected]
北京百灵威科技有限公司18210857532 18210857532 · [email protected]
DAYANG CHEM (HANGZHOU) CO.,LTD+86-88938639 +86-17705817739 · [email protected]
上海陶术生物科技股份有限公司+1-781-999-5354 · [email protected]
北京索莱宝科技有限公司17801761073 18101056239 · [email protected]
湖北实顺生物科技有限公司027-59223025 15107168801 · [email protected]
Additional notes
DefinitionChEBI: All-trans-violaxanthin is the all-trans-stereoisomer of violaxanthin. It has a role as a food colouring.
Related reactions
2 records
Compound notes
Loading…