ChemSpider 2D Image | b-Chlorophyll | C55H70MgN4O6

b-Chlorophyll

  • Molecular FormulaC55H70MgN4O6
  • Average mass907.472 Da
  • Monoisotopic mass906.514587 Da
  • ChemSpider ID16739843

  • Charge - Charge

    Double-bond stereo - Double-bond stereo

    defined stereocentres - 5 of 5 defined stereocentres

More details:

Validated by Experts, Validated by Users, Non-Validated, Removed by Users

[(1Z,3R,9Z,14Z,18Z,21S,22S)-16-éthènyl-11-éthyl-12-formyl-17,21,26-triméthyl-4-oxo-22-(3-oxo-3-{[(2E,7R,11R)-3,7,11,15-tétraméthyl-2-hexadécèn-1-yl]oxy}propyl)-7,23,24,25-tétraazahexacyclo[18.2.1.15,8.110,13.115,18.02,6]hexacosa-1,5,8(26),9,11,13(25),14,16,18,20(23)-décaène-3-carboxylatato(2-)-κ2N,N' de méthyle]magnésium
[(3S,4S,21R)-9-éthènyl-14-éthyl-13-formyl-4,8,18-triméthyl-20-oxo-3-(3-oxo-3-{[(2E,7R,11R)-3,7,11,15-tétraméthyl-2-hexadécèn-1-yl]oxy}propyl)-21-phorbinecarboxylatato(2-)-κ2N,N' de méthyle]magnésium
[Methyl (1Z,3R,9Z,14Z,18Z,21S,22S)-11-ethyl-12-formyl-17,21,26-trimethyl-4-oxo-22-(3-oxo-3-{[(2E,7R,11R)-3,7,11,15-tetramethyl-2-hexadecen-1-yl]oxy}propyl)-16-vinyl-7,23,24,25-tetraazahexacyclo[18.2.1.15,8.110,13.115,18.02,6]hexacosa-1,5,8(26),9,11,13(25),14,16,18,20(23)-decaene-3-carboxylatato(2-)-κ2N,N']magnesium
[Methyl (3S,4S,21R)-14-ethyl-13-formyl-4,8,18-trimethyl-20-oxo-3-(3-oxo-3-{[(2E,7R,11R)-3,7,11,15-tetramethyl-2-hexadecen-1-yl]oxy}propyl)-9-vinyl-21-phorbinecarboxylatato(2-)-κ2N,N']magnesium [ACD/IUPAC Name]
[Methyl (3S,4S,21R)-14-ethyl-13-formyl-4,8,18-trimethyl-20-oxo-3-(3-oxo-3-{[(2E,7R,11R)-3,7,11,15-tetramethylhexadec-2-en-1-yl]oxy}propyl)-9-vinylphorbine-21-carboxylatato(2-)-κ2N,N']magnesium
[methyl (3S,4S,21R)-9-ethenyl-14-ethyl-13-formyl-4,8,18-trimethyl-20-oxo-3-(3-oxo-3-{[(2E,7R,11R)-3,7,11,15-tetramethylhexadec-2-en-1-yl]oxy}propyl)phorbine-21-carboxylatato(2-)-κ2N,N']magnesium
[Methyl-(1Z,3R,9Z,14Z,18Z,21S,22S)-11-ethyl-12-formyl-17,21,26-trimethyl-4-oxo-22-(3-oxo-3-{[(2E,7R,11R)-3,7,11,15-tetramethyl-2-hexadecen-1-yl]oxy}propyl)-16-vinyl-7,23,24,25-tetraazahexacyclo[18.2.1.15,8.110,13.115,18.02,6]hexacosa-1,5,8(26),9,11,13(25),14,16,18,20(23)-decaen-3-carboxylatato(2-)-κ2N,N']magnesium
[Methyl-(1Z,3S,4S,6Z,10Z,15Z,21R)-14-ethyl-13-formyl-4,8,18-trimethyl-20-oxo-3-(3-oxo-3-{[(2E,7R,11R)-3,7,11,15-tetramethyl-2-hexadecen-1-yl]oxy}propyl)-9-vinylphorbin-21-carboxylatato(2-)-κ2N,N']magnesium
519-62-0 [RN]
b-Chlorophyll
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Validated by Experts, Validated by Users, Non-Validated, Removed by Users

25740_FLUKA [DBID]
C5878_SIGMA [DBID]

Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module, version: 14.00

Density:
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction:
Molar Refractivity:
#H bond acceptors: 10
#H bond donors: 0
#Freely Rotating Bonds: 23
#Rule of 5 Violations:
ACD/LogP:
ACD/LogD (pH 5.5):
ACD/BCF (pH 5.5):
ACD/KOC (pH 5.5):
ACD/LogD (pH 7.4):
ACD/BCF (pH 7.4):
ACD/KOC (pH 7.4):
Polar Surface Area: 120 Å2
Polarizability:
Surface Tension:
Molar Volume:

Click to predict properties on the Chemicalize site


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