Found 1 result

Search term: PDYODZVCODUKFH-ZOMLSHGTSA-L (Found by InChIKey (full match))
ChemSpider 2D Image | [3,3'-{3-Formyl-8-[(1S,4E,8E,12E)-1-hydroxy-5,9,13,17-tetramethyl-4,8,12,16-octadecatetraen-1-yl]-7,12,17-trimethyl-13-vinyl-2,18-porphyrindiyl-kappa~2~N~22~,N~24~}dipropanoato(2-)]iron | C54H64FeN4O6

[3,3'-{3-Formyl-8-[(1S,4E,8E,12E)-1-hydroxy-5,9,13,17-tetramethyl-4,8,12,16-octadecatetraen-1-yl]-7,12,17-trimethyl-13-vinyl-2,18-porphyrindiyl-κ2N22,N24}dipropanoato(2-)]iron

  • Molecular FormulaC54H64FeN4O6
  • Average mass920.954 Da
  • Monoisotopic mass920.417542 Da
  • ChemSpider ID61709328

  • Charge - Charge

    Double-bond stereo - Double-bond stereo

    defined stereocentres - 1 of 1 defined stereocentres

More details:

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

[3,3'-{3-Formyl-8-[(1S,4E,8E,12E)-1-hydroxy-5,9,13,17-tetramethyl-4,8,12,16-octadecatetraen-1-yl]-7,12,17-trimethyl-13-vinyl-2,18-porphyrindiyl-κ2N22,N24}dipropanoato(2-)]eisen [German] [ACD/IUPAC Name]
[3,3'-{3-Formyl-8-[(1S,4E,8E,12E)-1-hydroxy-5,9,13,17-tetramethyl-4,8,12,16-octadecatetraen-1-yl]-7,12,17-trimethyl-13-vinyl-2,18-porphyrindiyl-κ2N22,N24}dipropanoato(2-)]iron [ACD/IUPAC Name]
[3,3'-{3-Formyl-8-[(1S,4E,8E,12E)-1-hydroxy-5,9,13,17-tétraméthyl-4,8,12,16-octadécatétraén-1-yl]-7,12,17-triméthyl-13-vinyl-2,18-porphyrinediyl-κ2N22,N24}dipropanato(2-)]fer [French] [ACD/IUPAC Name]
Iron, [7-ethenyl-17-formyl-12-[(1S,4E,8E,12E)-1-hydroxy-5,9,13,17-tetramethyl-4,8,12,16-octadecatetraen-1-yl]-3,8,13-trimethyl-21H,23H-porphine-2,18-dipropanoato(2-)-κN21,κN23]- [ACD/Index Name]
HAS
HEME-AS

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: 3
#Freely Rotating Bonds: 22
#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: 145 Å2
Polarizability:
Surface Tension:
Molar Volume:

Click to predict properties on the Chemicalize site


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