Neoxanthin

Base Information Edit

Chemical Name:Neoxanthin
CAS No.:14660-91-4
Deprecated CAS:23727-42-6,2034-64-2,157966-40-0
Molecular Formula:C₄₀H₅₆O₄
Molecular Weight:600.882
Hs Code.:29109000
UNII:KK8M5T48AI
DSSTox Substance ID:DTXSID701318362
Metabolomics Workbench ID:29010
Nikkaji Number:J1.272.684H
Wikidata:Q27104309
Wikipedia:Neoxanthin
Mol file:14660-91-4.mol

Synonyms:9'-cis-neoxanthin;neoxanthin;neoxanthin, (trans)-isomer

Suppliers and Price of Neoxanthin

Supply Marketing:Edit

Business phase:: The product has achieved commercial mass production^*data from LookChem market partment

Manufacturers and distributors:

Manufacture/Brand
Chemicals and raw materials
Packaging
price

Biosynth Carbosynth
(3S,3'S,5R,5'R,6R,6'S,9'-cis)-6,7-Didehydro-5',6'-epoxy-5',6'-dihydro-B,beta-carotene-3,3',5(6H)-triol - solution in ethanol
1 g
$ 550.00

Biosynth Carbosynth
(3S,3'S,5R,5'R,6R,6'S,9'-cis)-6,7-Didehydro-5',6'-epoxy-5',6'-dihydro-B,beta-carotene-3,3',5(6H)-triol - solution in ethanol
500 mg
$ 360.00

Biosynth Carbosynth
(3S,3'S,5R,5'R,6R,6'S,9'-cis)-6,7-Didehydro-5',6'-epoxy-5',6'-dihydro-B,beta-carotene-3,3',5(6H)-triol - solution in ethanol
250 mg
$ 215.00

Biosynth Carbosynth
(3S,3'S,5R,5'R,6R,6'S,9'-cis)-6,7-Didehydro-5',6'-epoxy-5',6'-dihydro-B,beta-carotene-3,3',5(6H)-triol - solution in ethanol
100 mg
$ 120.00

Biosynth Carbosynth
(3S,3'S,5R,5'R,6R,6'S,9'-cis)-6,7-Didehydro-5',6'-epoxy-5',6'-dihydro-B,beta-carotene-3,3',5(6H)-triol - solution in ethanol
50 mg
$ 70.00

American Custom Chemicals Corporation
NEOXANTHIN 95.00%
1G
$ 691.27

Total 10 raw suppliers

Chemical Property of Neoxanthin Edit

Chemical Property:

Vapor Pressure:0mmHg at 25°C
Boiling Point:733.3 °C at 760 mmHg
PKA:14.65±0.60(Predicted)
Flash Point:397.3 °C
PSA：73.22000
Density:1.06 g/cm³
LogP:8.95340
Storage Temp.:-20°C
XLogP3:8.7
Hydrogen Bond Donor Count:3
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:9
Exact Mass:600.41786026
Heavy Atom Count:44
Complexity:1380

Purity/Quality:

98%,99%, ^*data from raw suppliers

(3S,3'S,5R,5'R,6R,6'S,9'-cis)-6,7-Didehydro-5',6'-epoxy-5',6'-dihydro-B,beta-carotene-3,3',5(6H)-triol - solution in ethanol ^*data from reagent suppliers

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:CC(=CC=CC=C(C)C=CC=C(C)C=C=C1C(CC(CC1(C)O)O)(C)C)C=CC=C(C)C=CC23C(CC(CC2(O3)C)O)(C)C
Isomeric SMILES:C/C(=C\C=C\C=C(/C)\C=C\C=C(/C)\C=C=C1[C@](C[C@H](CC1(C)C)O)(C)O)/C=C/C=C(/C)\C=C\[C@]23[C@](O2)(C[C@H](CC3(C)C)O)C
Uses Neoxanthin may be used as a reference standard in the determination of the analyte in fruits using high-performance liquid chromatography (HPLC) coupled with diode array detector (DAD) and mass spectrometry (MS).)

Technology Process of Neoxanthin

There total 4 articles about Neoxanthin which guide to synthetic route it. The literature collected by LookChem mainly comes from the sharing of users and the free literature resources found by Internet computing technology. We keep the original model of the professional version of literature to make it easier and faster for users to retrieve and use. At the same time, we analyze and calculate the most feasible synthesis route with the highest yield for your reference as below:

synthetic route:

Reference yield: 75.0%

: 142204-43-1,142236-47-3,142236-49-5
(9'Z)-15,15'-Didehydroneoxanthin

: 10153-97-6,14660-91-4,17708-84-8,19254-47-8,21888-00-6,21888-01-7,21888-02-8,21888-03-9,21888-04-0,21888-05-1,21888-06-2,25493-63-4,27780-09-2,29363-88-0,30743-41-0,52949-72-1,52949-73-2,142236-46-2,142236-48-4,142236-50-8
(15Z,9'Z)-Neoxanthin

Guidance literature:: With hydrogen; Lindlar's catalyst; In methanol;
DOI:10.1002/hlca.19940770405

Reference yield:

: 10153-97-6,14660-91-4,17708-84-8,19254-47-8,21888-00-6,21888-01-7,21888-02-8,21888-03-9,21888-04-0,21888-05-1,21888-06-2,25493-63-4,27780-09-2,29363-88-0,30743-41-0,52949-72-1,52949-73-2,142236-46-2,142236-48-4,142236-50-8
(15Z,9'Z)-Neoxanthin

: 10153-97-6,14660-91-4,17708-84-8,19254-47-8,21888-00-6,21888-01-7,21888-02-8,21888-03-9,21888-04-0,21888-05-1,21888-06-2,25493-63-4,27780-09-2,29363-88-0,30743-41-0,52949-72-1,52949-73-2,142236-46-2,142236-48-4,142236-50-8
(15E,9'Z)-neoxanthin

Guidance literature:: In ethyl acetate; at 97 ℃; for 4h;
DOI:10.1002/hlca.19940770405

Reference yield:

: 142204-43-1,142236-47-3,142236-49-5
15,15'-Didehydroneoxanthin

: 10153-97-6,14660-91-4,17708-84-8,19254-47-8,21888-00-6,21888-01-7,21888-02-8,21888-03-9,21888-04-0,21888-05-1,21888-06-2,25493-63-4,27780-09-2,29363-88-0,30743-41-0,52949-72-1,52949-73-2,142236-46-2,142236-48-4,142236-50-8
neoxanthin

Guidance literature:: With hydrogen; N-ethyl-N,N-diisopropylamine; Lindlar's catalyst; Multistep reaction; 1) EtOAc, r.t., 2) heptane, 100 deg C, 1 h;
DOI:10.1002/hlca.19920750314