3-[2-[(Z)-[(5Z)-3-(2-Carboxyethyl)-5-[[(3Z,4R)-3-Ethylidene-4-Methyl-5-Oxo-Pyrrol-2-Yl]Methylene]-4-Methyl-Pyrrol-2-Ylidene]Methyl]-4-Methyl-5-[[(2R)-3-Methyl-5-Oxo-4-Vinyl-1,2-Dihydropyrrol-2-Yl]Methyl]-1H-Pyrrol-3-Yl]Propanoic Acid

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Properties Simple | Detailed

Formula C33H16N4O6
IUPAC Name 3-[2-[(z)-[(5z)-3-(2-carboxyethyl)-5-[[(3z,4r)-3-ethylidene-4-methyl-5-oxopyrrol-2-yl]methylidene]-4-methylpyrrol-2-ylidene]methyl]-5-[[(2r)-4-ethenyl-3-methyl-5-oxo-1,2-dihydropyrrol-2-yl]methyl]-4-methyl-1h-pyrrol-3-yl]propanoic acid
Molecular Mass 564.503 g·mol−1
Heat of Formation 2857.6 ± 16.7 kJ·mol−1
Dipole Moment 10.58 ± 1.08 D
Volume 610.69 Å 3
Surface Area 489.44 Å 2
Point Group Symmetry C1
Synonyms
  • (3z)-phycoerythrobilin
  • 3-[2-[(z)-[(5z)-3-(2-carboxyethyl)-5-[[(3z,4r)-3-ethylidene-4-methyl-5-oxo-2-pyrrolyl]methylene]-4-methyl-2-pyrrolylidene]methyl]-4-methyl-5-[[(2r)-3-methyl-5-oxo-4-vinyl-1,2-dihydropyrrol-2-yl]methyl]-1h-pyrrol-3-yl]propanoic acid
  • 3-[2-[(z)-[(5z)-3-(2-carboxyethyl)-5-[[(3z,4r)-3-ethylidene-4-methyl-5-oxo-pyrrol-2-yl]methylidene]-4-methyl-pyrrol-2-ylidene]methyl]-5-[[(2r)-4-ethenyl-3-methyl-5-oxo-1,2-dihydropyrrol-2-yl]methyl]-4-methyl-1h-pyrrol-3-yl]propanoic acid
  • 3-[2-[(z)-[(5z)-3-(2-carboxyethyl)-5-[[(3z,4r)-3-ethylidene-5-keto-4-methyl-1-pyrrolin-2-yl]methylene]-4-methyl-3-pyrrolin-2-ylidene]methyl]-5-[[(2r)-5-keto-3-methyl-4-vinyl-3-pyrrolin-2-yl]methyl]-4-methyl-1h-pyrrol-3-yl]propionic acid
InChIKey GLWKVDXAQHCAIO-REYDXQAISA-N
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