ChemSpider 2D Image | MFCD00167403 | C2513CH43NO6

MFCD00167403

  • Molecular FormulaC2513CH43NO6
  • Average mass466.615 Da
  • Monoisotopic mass466.312378 Da
  • ChemSpider ID17340039

  • defined stereocentres - 11 of 11 defined stereocentres

    Non-standard isotope - Non-standard isotope

More details:

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

Glycine-1-13C, N-[(3α,5β,7α,12α)-3,7,12-trihydroxy-24-oxocholan-24-yl]- [ACD/Index Name]
Glycocholic acid-(glycyl-1-13C)
MFCD00167403
N-[(3α,5β,7α,12α)-3,7,12-Trihydroxy-24-oxocholan-24-yl](1-13C)glycin [German] [ACD/IUPAC Name]
N-[(3α,5β,7α,12α)-3,7,12-Trihydroxy-24-oxocholan-24-yl](1-13C)glycine [ACD/IUPAC Name]
N-[(3α,5β,7α,12α)-3,7,12-Trihydroxy-24-oxocholan-24-yl](1-13C)glycine [French] [ACD/IUPAC Name]
64431-95-4 [RN]
81-25-4 [RN]
CHOLIC ACID (CA)
cholic acid ??????
More...

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

Density: 1.2±0.1 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.560
Molar Refractivity: 124.1±0.3 cm3
#H bond acceptors:
#H bond donors:
#Freely Rotating Bonds:
#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:
Polarizability: 49.2±0.5 10-24cm3
Surface Tension: 52.8±3.0 dyne/cm
Molar Volume: 383.8±3.0 cm3

Click to predict properties on the Chemicalize site


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