ChemSpider 2D Image | 6-{[(2-{[3-(4-Azido-3-iodophenyl)propanoyl]amino}ethyl)carbamoyl]oxy}-10,10b-dihydroxy-3,4a,7,7,10a-pentamethyl-1-oxo-3-vinyldodecahydro-1H-benzo[f]chromen-5-yl acetate | C34H46IN5O9

6-{[(2-{[3-(4-Azido-3-iodophenyl)propanoyl]amino}ethyl)carbamoyl]oxy}-10,10b-dihydroxy-3,4a,7,7,10a-pentamethyl-1-oxo-3-vinyldodecahydro-1H-benzo[f]chromen-5-yl acetate

  • Molecular FormulaC34H46IN5O9
  • Average mass795.662 Da
  • Monoisotopic mass795.234009 Da
  • ChemSpider ID120331409

More details:

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

6-{[(2-{[3-(4-Azido-3-iodophenyl)propanoyl]amino}ethyl)carbamoyl]oxy}-10,10b-dihydroxy-3,4a,7,7,10a-pentamethyl-1-oxo-3-vinyldodecahydro-1H-benzo[f]chromen-5-yl acetate [ACD/IUPAC Name]
6-{[(2-{[3-(4-Azido-3-iodphenyl)propanoyl]amino}ethyl)carbamoyl]oxy}-10,10b-dihydroxy-3,4a,7,7,10a-pentamethyl-1-oxo-3-vinyldodecahydro-1H-benzo[f]chromen-5-yl-acetat [German] [ACD/IUPAC Name]
Acétate de 6-{[(2-{[3-(4-azido-3-iodophényl)propanoyl]amino}éthyl)carbamoyl]oxy}-10,10b-dihydroxy-3,4a,7,7,10a-pentaméthyl-1-oxo-3-vinyldodécahydro-1H-benzo[f]chromén-5-yle [French] [ACD/IUPAC Name]
Carbamic acid, N-[2-[[3-(4-azido-3-iodophenyl)-1-oxopropyl]amino]ethyl]-, 5-(acetyloxy)-3-ethenyldodecahydro-10,10b-dihydroxy-3,4a,7,7,10a-pentamethyl-1-oxo-1H-naphtho[2,1-b]pyran-6-yl ester [ACD/Index Name]

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: 14
#H bond donors: 4
#Freely Rotating Bonds: 12
#Rule of 5 Violations: 3
ACD/LogP: 6.37
ACD/LogD (pH 5.5): 5.67
ACD/BCF (pH 5.5): 12063.91
ACD/KOC (pH 5.5): 29048.03
ACD/LogD (pH 7.4): 5.67
ACD/BCF (pH 7.4): 12057.67
ACD/KOC (pH 7.4): 29033.01
Polar Surface Area: 173 Å2
Polarizability:
Surface Tension:
Molar Volume:

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