ChemSpider 2D Image | 1-[2-Iodo-4-(3-oxo-3-{[2-({[(6,10,10b-trihydroxy-3,4a,7,7,10a-pentamethyl-1-oxo-3-vinyldodecahydro-1H-benzo[f]chromen-5-yl)oxy]carbonyl}amino)ethyl]amino}propyl)phenyl]-1,2-triazadien-2-ium | C32H45IN5O8

1-[2-Iodo-4-(3-oxo-3-{[2-({[(6,10,10b-trihydroxy-3,4a,7,7,10a-pentamethyl-1-oxo-3-vinyldodecahydro-1H-benzo[f]chromen-5-yl)oxy]carbonyl}amino)ethyl]amino}propyl)phenyl]-1,2-triazadien-2-ium

  • Molecular FormulaC32H45IN5O8
  • Average mass754.632 Da
  • Monoisotopic mass754.230713 Da
  • ChemSpider ID95640343

  • Charge - Charge

More details:

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

1,2-Triazadien-2-ium, 1-[4-[3-[[2-[[[(3-ethenyldodecahydro-6,10,10b-trihydroxy-3,4a,7,7,10a-pentamethyl-1-oxo-1H-naphtho[2,1-b]pyran-5-yl)oxy]carbonyl]amino]ethyl]amino]-3-oxopropyl]-2-iodophenyl]- [ACD/Index Name]
1-[2-Iod-4-(3-oxo-3-{[2-({[(6,10,10b-trihydroxy-3,4a,7,7,10a-pentamethyl-1-oxo-3-vinyldodecahydro-1H-benzo[f]chromen-5-yl)oxy]carbonyl}amino)ethyl]amino}propyl)phenyl]-1,2-triazadien-2-ium [German] [ACD/IUPAC Name]
1-[2-Iodo-4-(3-oxo-3-{[2-({[(6,10,10b-trihydroxy-3,4a,7,7,10a-pentamethyl-1-oxo-3-vinyldodecahydro-1H-benzo[f]chromen-5-yl)oxy]carbonyl}amino)ethyl]amino}propyl)phenyl]-1,2-triazadien-2-ium [ACD/IUPAC Name]
1-[2-Iodo-4-(3-oxo-3-{[2-({[(6,10,10b-trihydroxy-3,4a,7,7,10a-pentaméthyl-1-oxo-3-vinyldodécahydro-1H-benzo[f]chromén-5-yl)oxy]carbonyl}amino)éthyl]amino}propyl)phényl]-1,2-triazadién-2-ium [French] [ACD/IUPAC Name]

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

Density:
Boiling Point:
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Index of Refraction:
Molar Refractivity:
#H bond acceptors: 13
#H bond donors: 6
#Freely Rotating Bonds: 10
#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: 191 Å2
Polarizability:
Surface Tension:
Molar Volume:

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