ChemSpider 2D Image | Methylcobalamin | C63H91CoN13O14P

Methylcobalamin

  • Molecular FormulaC63H91CoN13O14P
  • Average mass1344.382 Da
  • Monoisotopic mass1343.587769 Da
  • ChemSpider ID29368587
  • Charge - Charge

    defined stereocentres - 14 of 14 defined stereocentres


More details:






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

Methylcobalamin [Wiki]
13422-55-4 [RN]
30,35,40-tris(2-carbamoylethyl)-24,36,41-tris(carbamoylmethyl)-46-hydroxy-12-(hydroxymethyl)-1,5,6,17,23,28,31,31,36,38,41,42-dodecamethyl-15,20-dioxo-11,14,16-trioxa-2λ4,9,19,26,43λ4,44λ4,45λ4-heptaaza-15λ5-phospha-1-cobaltadodecacyclo[27.14.1.11,34.12,9.110,13.01,26.03,8.023,27.025,42.032,44.039,43.037,45]heptatetraconta-2(47),3(8),4,6,27,29(44),32,34(45),37,39(43)-decaene-1,1,1-tris(ylium)-15-olateAlgobaz
Algobaz
BR1SN1JS2W
CO-METHYLCOBALAMIN
Co-methylcobalamin; MeCbl; mecobalamin; methyl(III)cobalamin; Methylcobalamin
Coα-[α-(5,6-dimethylbenzimidazolyl)]-Cobeta-methylcobamide
Hitocobamin M
MeCbl
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Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module

Density:
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction:
Molar Refractivity:
#H bond acceptors: 27
#H bond donors: 16
#Freely Rotating Bonds: 18
#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: 427 Å2
Polarizability:
Surface Tension:
Molar Volume:

Click to predict properties on the Chemicalize site





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