Methyl 3-[2-[[3-(3-Methoxy-3-Oxo-Propyl)-4-Methyl-5-[(Z)-(4-Methyl-5-Oxo-3-Vinyl-Pyrrol-2-Ylidene)Methyl]-1H-Pyrrol-2-Yl]Methyl]-4-Methyl-5-[(Z)-(3-Methyl-5-Oxo-4-Vinyl-Pyrrol-2-Ylidene)Methyl]-1H-Pyrrol-3-Yl]Propanoate

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Properties Simple | Detailed

Formula C35H40N4O6
IUPAC Name methyl 3-[2-[[3-(3-methoxy-3-oxo-propyl)-4-methyl-5-[(z)-(4-methyl-5-oxo-3-vinyl-pyrrol-2-ylidene)methyl]pyrrol-1-ium-2-ylium-2-yl]methyl]-4-methyl-5-[(z)-(3-methyl-5-oxo-4-vinyl-pyrrol-2-ylidene)methyl]pyrrol-1-ium-2-ylium-3-yl]propanoate
Molecular Mass 612.715 g·mol−1
Heat of Formation -732.2 ± 16.7 kJ·mol−1
Dipole Moment 4.64 ± 1.08 D
Volume 773.57 Å 3
Surface Area 579.42 Å 2
HOMO Energy -8.29 ± 0.55 eV
LUMO Energy -1.17 ± eV
Point Group Symmetry C1
Synonyms
  • 21h-biline-8,12-dipropanoic acid, 2,17-diethenyl-1,10,19,22,23,24-hexahydro-3,7,13,18-tetramethyl-1,19-dioxo-, dimethyl ester
  • 3-[2-[[3-(3-keto-3-methoxy-propyl)-5-[(z)-(5-keto-4-methyl-3-vinyl-3-pyrrolin-2-ylidene)methyl]-4-methyl-1h-pyrrol-2-yl]methyl]-5-[(z)-(5-keto-3-methyl-4-vinyl-3-pyrrolin-2-ylidene)methyl]-4-methyl-1h-pyrrol-3-yl]propionic acid methyl ester
  • 3-[2-[[3-(3-methoxy-3-oxopropyl)-4-methyl-5-[(z)-(4-methyl-5-oxo-3-vinyl-2-pyrrolylidene)methyl]-1h-pyrrol-2-yl]methyl]-4-methyl-5-[(z)-(3-methyl-5-oxo-4-vinyl-2-pyrrolylidene)methyl]-1h-pyrrol-3-yl]propanoic acid methyl ester
  • bilirubin dimethyl diester
  • bilirubin dimethyl ester
  • dimethyl bilirubin
  • methyl 3-[5-[(z)-(4-ethenyl-3-methyl-5-oxo-pyrrol-2-ylidene)methyl]-2-[[5-[(z)-(3-ethenyl-4-methyl-5-oxo-pyrrol-2-ylidene)methyl]-3-(3-methoxy-3-oxo-propyl)-4-methyl-1h-pyrrol-2-yl]methyl]-4-methyl-1h-pyrrol-3-yl]propanoate
  • methyl 3-[5-[(z)-(4-ethenyl-3-methyl-5-oxopyrrol-2-ylidene)methyl]-2-[[5-[(z)-(3-ethenyl-4-methyl-5-oxopyrrol-2-ylidene)methyl]-3-(3-methoxy-3-oxopropyl)-4-methyl-1h-pyrrol-2-yl]methyl]-4-methyl-1h-pyrrol-3-yl]propanoate
CAS Number(s)
  • 19792-68-8
  • 19793-01-2
  • 69712-27-2
InChIKey UWZUXDQSJUVVTL-FLZZTMJYSA-N
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