Account MEsobilirubin
- Catalog No. :
- ACOBWQ526
- CAS No. :
- 16568-56-2
- Molecular Formula :
- C33H40N4O6
- Molecular Weight :
- 588.71
IUPAC Name:3-(2-((3-(2-carboxyethyl)-5-((E)-(3-ethyl-4-methyl-5-oxo-1,5-dihydro-2H-pyrrol-2-ylidene)methyl)-4-methyl-1H-pyrrol-2-yl)methyl)-5-((E)-(4-ethyl-3-methyl-5-oxo-1,5-dihydro-2H-pyrrol-2-ylidene)methyl)-4-methyl-1H-pyrrol-3-yl)propanoic acid
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Product Information
| Product Name | MEsobilirubin |
|---|---|
| IUPAC Name | 3-(2-((3-(2-carboxyethyl)-5-((E)-(3-ethyl-4-methyl-5-oxo-1,5-dihydro-2H-pyrrol-2-ylidene)methyl)-4-methyl-1H-pyrrol-2-yl)methyl)-5-((E)-(4-ethyl-3-methyl-5-oxo-1,5-dihydro-2H-pyrrol-2-ylidene)methyl)-4-methyl-1H-pyrrol-3-yl)propanoic acid |
| Molecular Formula | C33H40N4O6 |
| Molecular Weight | 588.71 |
| SMILES | CCC1=C(C)/C(=C\C2=C(C)C(CCC(=O)O)=C(CC3=C(CCC(=O)O)C(C)=C(/C=C4/NC(=O)C(C)=C4CC)N3)N2)NC1=O |
| InChI Key | HVHKMUMXERBUAN-BMNRKXRESA-N |
| Synonym | CHEBI:25208 | mesobilirubin IXalpha | 21H-Biline-8,12-dipropanoic acid, 2,17-diethyl-1,10,19,22,23,24-hexahydro-3,7,13,18-tetramethyl-1,19-dioxo- | Q27109872 | SCHEMBL3892962 | 3-[2-[[3-(2-carboxyethyl)-5-[(Z)-(3-ethyl-4-methyl-5-oxo-pyrrol-2-ylidene)meth |
| CAS No. | 16568-56-2 |
| PubChem CID | 5941884 |
Synthetic Route by SureRoute
2. ACOBWQ526 Molecular Building Block Synthetic Route
3-(2-((3-(2-Carboxyethyl)-4-methyl-5-((Z)-(3-methyl-5-oxo-4-vinyl-1H-pyrrol-2(5H)-ylidene)methyl)-1H-pyrrol-2-yl)methyl)-4-methyl-5-((Z)-(4-methyl-5-oxo-3-vinyl-1H-pyrrol-2(5H)-ylidene)methyl)-1H-pyrrol-3-yl)propanoic acid
Bilirubindimethylester
(2S,3S,4S,5R,6S)-6-((3-(2-((3-(3-(((2S,3R,4S,5S,6S)-6-Carboxy-3,4,5-trihydroxytetrahydro-2H-pyran-2-yl)oxy)-3-oxopropyl)-4-methyl-5-((Z)-(3-methyl-5-oxo-4-vinyl-1,5-dihydro-2H-pyrrol-2-ylidene)methyl)-1H-pyrrol-2-yl)methyl)-4-methyl-5-((Z)-(4-methyl-5-oxo-3-vinyl-1,5-dihydro-2H-pyrrol-2-ylidene)methyl)-1H-pyrrol-3-yl)propanoyl)oxy)-3,4,5-trihydroxytetrahydro-2H-pyran-2-carboxylic acid