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

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Properties Simple | Detailed

Formula C25H14N4O6
IUPAC Name carbon dioxide; 5-[[4-ethynyl-3-methyl-5-[[4-methylene-5-[(2s)-2-nitrosocyclopropyl]-3-[(3-oxooxiran-2-ylidene)methylene]pyrrol-1-ium-2-ylidene]methylene]pyrrol-1-ium-2-yl]methyl]pyrrol-1-ium-2-one
Molecular Mass 466.402 g·mol−1
Heat of Formation 3438.1 ± 16.7 kJ·mol−1
Dipole Moment 4.67 ± 1.08 D
Volume 543.56 Å 3
Surface Area 453.0 Å 2
HOMO Energy -9.31 ± 0.55 eV
LUMO Energy -2.67 ± eV
Point Group Symmetry C1
Synonyms
  • 21h-biline-8,12-dipropanoic acid, 3,18-diethenyl-1,19,22,24-tetrahydro-2,7,13,17-tetramethyl-1,19-dioxo-
  • 3-[2-[(z)-[(5z)-3-(2-carboxyethyl)-4-methyl-5-[(3-methyl-5-oxo-4-vinyl-2-pyrrolyl)methylene]-2-pyrrolylidene]methyl]-4-methyl-5-[(z)-(4-methyl-5-oxo-3-vinyl-2-pyrrolylidene)methyl]-1h-pyrrol-3-yl]propanoic acid
  • 3-[2-[(z)-[(5z)-3-(2-carboxyethyl)-5-[(4-ethenyl-3-methyl-5-oxo-pyrrol-2-yl)methylidene]-4-methyl-pyrrol-2-ylidene]methyl]-5-[(z)-(3-ethenyl-4-methyl-5-oxo-pyrrol-2-ylidene)methyl]-4-methyl-1h-pyrrol-3-yl]propanoic acid
  • 3-[2-[(z)-[(5z)-3-(2-carboxyethyl)-5-[(4-ethenyl-3-methyl-5-oxopyrrol-2-yl)methylidene]-4-methylpyrrol-2-ylidene]methyl]-5-[(z)-(3-ethenyl-4-methyl-5-oxopyrrol-2-ylidene)methyl]-4-methyl-1h-pyrrol-3-yl]propanoic acid
  • 3-[2-[(z)-[(5z)-3-(2-carboxyethyl)-5-[(5-keto-3-methyl-4-vinyl-pyrrol-2-yl)methylene]-4-methyl-3-pyrrolin-2-ylidene]methyl]-5-[(z)-(5-keto-4-methyl-3-vinyl-3-pyrrolin-2-ylidene)methyl]-4-methyl-1h-pyrrol-3-yl]propionic acid
  • 8,12-bis(2-carboxyethyl)-2,7,13,17-tetramethyl-3,18-divinylbilin-1(19)(21h,24h)-dione
  • biline-8,12-dipropionic acid, 1,19,22,24-tetrahydro-2,7,13,17-tetramethyl-1,19-dioxo-3,18-divinyl- (8ci)
  • biliverdin ixalpha
  • biliverdin ixalpha; biliverdine (van)
  • biliverdine dihydrochloride
  • oocyan
CAS Number(s)
  • 493-89-0
  • 189246-93-3
  • 27818-05-9
  • 29575-14-2
  • 114-25-0
InChIKey RCNSAJSGRJSBKK-NSQVQWHSSA-N
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