ChemSpider 2D Image | Elcatonin | C148H244N42O47

Elcatonin

  • Molecular FormulaC148H244N42O47
  • Average mass3363.774 Da
  • Monoisotopic mass3361.799316 Da
  • ChemSpider ID17294280

  • defined stereocentres - 32 of 32 defined stereocentres

More details:

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

60731-46-6 [RN]
Elcatonin
L-Prolinamide, N-[[(2S,5S,8S,11S,14S,17S)-5-(2-amino-2-oxoethyl)-14-[(1R)-1-hydroxyethyl]-2,11-bis(hydroxymethyl)-8-(2-methylpropyl)-3,6,9,12,15,23-hexaoxo-1,4,7,10,13,16-hexaazacyclotricos-17-yl]carb ;onyl]-L-valyl-L-leucylglycyl-L-lysyl-L-leucyl-L-seryl-L-glutaminyl-L-α-glutamyl-L-leucyl-L-histidyl-L-lysyl-L-leucyl-L-glutaminyl-L-threonyl-L-tyrosyl-L-prolyl-L-arginyl-L-threonyl-L-α-asparty l-L-valylglycyl-L-alanylglycyl-L-threonyl- [ACD/Index Name]
N-{[(2S,5S,8S,11S,14S,17S)-5-(2-Amino-2-oxoethyl)-14-[(1R)-1-hydroxyethyl]-2,11-bis(hydroxymethyl)-8-isobutyl-3,6,9,12,15,23-hexaoxo-1,4,7,10,13,16-hexaazacyclotricosan-17-yl]carbonyl}-L-valyl-L-leucy ;lglycyl-L-lysyl-L-leucyl-L-seryl-L-glutaminyl-L-α-glutamyl-L-leucyl-L-histidyl-L-lysyl-L-leucyl-L-glutaminyl-L-threonyl-L-tyrosyl-L-prolyl-L-arginyl-L-threonyl-L-α-asparagyl-L-valylglycyl-L-al anylglycyl-L-threonyl-L-prolinamid [German] [ACD/IUPAC Name]
N-{[(2S,5S,8S,11S,14S,17S)-5-(2-Amino-2-oxoethyl)-14-[(1R)-1-hydroxyethyl]-2,11-bis(hydroxymethyl)-8-isobutyl-3,6,9,12,15,23-hexaoxo-1,4,7,10,13,16-hexaazacyclotricosan-17-yl]carbonyl}-L-valyl-L-leucy ;lglycyl-L-lysyl-L-leucyl-L-seryl-L-glutaminyl-L-α-glutamyl-L-leucyl-L-histidyl-L-lysyl-L-leucyl-L-glutaminyl-L-threonyl-L-tyrosyl-L-prolyl-L-arginyl-L-threonyl-L-α-aspartyl-L-valylglycyl-L-ala nylglycyl-L-threonyl-L-prolinamide [ACD/IUPAC Name]
N-{[(2S,5S,8S,11S,14S,17S)-5-(2-Amino-2-oxoéthyl)-14-[(1R)-1-hydroxyéthyl]-2,11-bis(hydroxyméthyl)-8-isobutyl-3,6,9,12,15,23-hexaoxo-1,4,7,10,13,16-hexaazacyclotricosan-17-yl]carbonyl}-L-valyl-L-leucy ;lglycyl-L-lysyl-L-leucyl-L-séryl-L-glutaminyl-L-α-glutamyl-L-leucyl-L-histidyl-L-lysyl-L-leucyl-L-glutaminyl-L-thréonyl-L-tyrosyl-L-prolyl-L-arginyl-L-thréonyl-L-α-aspartyl-L-valylglycyl-L-ala nylglycyl-L-thréonyl-L-prolinamide [French] [ACD/IUPAC Name]
(Des-Cys1,cyclo(Ser2-Asu7))-Calcitonin (eel)
[60731-46-6] [RN]
Elcatonin acetate
MFCD00221767

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

Density: 1.5±0.1 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.659
Molar Refractivity: 829.4±0.5 cm3
#H bond acceptors: 89
#H bond donors: 56
#Freely Rotating Bonds: 107
#Rule of 5 Violations: 3
ACD/LogP: -9.41
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: 1436 Å2
Polarizability: 328.8±0.5 10-24cm3
Surface Tension: 64.7±7.0 dyne/cm
Molar Volume: 2248.4±7.0 cm3

Click to predict properties on the Chemicalize site


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