Mesobilirubin

Base Information Edit

Chemical Name:Mesobilirubin
CAS No.:16568-56-2
Molecular Formula:C33H40 N4 O6
Molecular Weight:586.68
Hs Code.:
European Community (EC) Number:686-001-2
DSSTox Substance ID:DTXSID401316200
Nikkaji Number:J34.209B
Wikidata:Q27109872
Metabolomics Workbench ID:53960
Mol file:16568-56-2.mol

Synonyms:Mesobilirubin;16568-56-2;Mesobilirubin IX alpha;mesobilirubin IXalpha;3-[2-[[3-(2-carboxyethyl)-5-[(Z)-(3-ethyl-4-methyl-5-oxopyrrol-2-ylidene)methyl]-4-methyl-1H-pyrrol-2-yl]methyl]-5-[(Z)-(4-ethyl-3-methyl-5-oxopyrrol-2-ylidene)methyl]-4-methyl-1H-pyrrol-3-yl]propanoic acid;2,17-diethyl-3,7,13,18-tetramethyl-1,19-dioxo-1,10,19,22,23,24-hexahydro-21H-biline-8,12-dipropanoic acid;21H-Biline-8,12-dipropanoic acid, 2,17-diethyl-1,10,19,22,23,24-hexahydro-3,7,13,18-tetramethyl-1,19-dioxo-;3-(2-(3-(2-Carboxy-ethyl)-5-(4-ethyl-3-methyl-5-oxo-1,5-dihydro-pyrrol-2-ylidenemethyl)-4-methyl-1H-pyrrol-2-ylmethyl)-5-(3-ethyl-4-methyl-5-oxo-1,5-dihydro-pyrrol-2-ylidenemethyl)-4-methyl-1H-pyrrol-3-yl)-propionic acid;3-[2-[3-(2-Carboxy-ethyl)-5-(4-ethyl-3-methyl-5-oxo-1,5-dihydro-pyrrol-2-ylidenemethyl)-4-methyl-1H-pyrrol-2-ylmethyl]-5-(3-ethyl-4-methyl-5-oxo-1,5-dihydro-pyrrol-2-ylidenemethyl)-4-methyl-1H-pyrrol-3-yl]-propionic acid;mesobilirubin-IXalpha;SCHEMBL3892962;CHEBI:25208;DTXSID401316200;J-010223;Q27109872;3-(2-{[3-(2-carboxyethyl)-5-{[(2Z)-3-ethyl-4-methyl-5-oxo-2,5-dihydro-1H-pyrrol-2-ylidene]methyl}-4-methyl-1H-pyrrol-2-yl]methyl}-5-{[(2Z)-4-ethyl-3-methyl-5-oxo-2,5-dihydro-1H-pyrrol-2-ylidene]methyl}-4-methyl-1H-pyrrol-3-yl)propanoic acid;3-[2-[[3-(2-carboxyethyl)-5-[(Z)-(3-ethyl-4-methyl-5-oxo-pyrrol-2-ylidene)methyl]-4-methyl-1H-pyrrol-2-yl]methyl]-5-[(Z)-(4-ethyl-3-methyl-5-oxo-pyrrol-2-ylidene)methyl]-4-methyl-1H-pyrrol-3-yl]propanoic acid

Suppliers and Price of Mesobilirubin

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

American Custom Chemicals Corporation
MESOBILIRUBIN 95.00%
200MG
$ 798.11

American Custom Chemicals Corporation
MESOBILIRUBIN 95.00%
50MG
$ 636.70

Total 2 raw suppliers

Chemical Property of Mesobilirubin Edit

Chemical Property:

Vapor Pressure:6.1E-35mmHg at 25°C
Melting Point:315-320 °C(Solv: chloroform (67-66-3))
Boiling Point:900.9°Cat760mmHg
PKA:4.62±0.10(Predicted)
Flash Point:498.7°C
PSA：164.38000
Density:1.283g/cm³
LogP:5.63680
Storage Temp.:?20°C
XLogP3:2.9
Hydrogen Bond Donor Count:6
Hydrogen Bond Acceptor Count:6
Rotatable Bond Count:12
Exact Mass:588.29478501
Heavy Atom Count:43
Complexity:1280

Purity/Quality:

99% ^*data from raw suppliers

MESOBILIRUBIN 95.00% ^*data from reagent suppliers

Safty Information:

Pictogram(s): Xi
Hazard Codes:Xi
Statements: 36/37/38
Safety Statements: 26

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:CCC1=C(C(=CC2=C(C(=C(N2)CC3=C(C(=C(N3)C=C4C(=C(C(=O)N4)C)CC)C)CCC(=O)O)CCC(=O)O)C)NC1=O)C
Isomeric SMILES:CCC1=C(/C(=C/C2=C(C(=C(N2)CC3=C(C(=C(N3)/C=C\4/C(=C(C(=O)N4)C)CC)C)CCC(=O)O)CCC(=O)O)C)/NC1=O)C

Technology Process of Mesobilirubin

There total 12 articles about Mesobilirubin 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: 90.0%