Found 9 results

Search term: MF = 'C_{32}H_{46}N_{6}O_{9}'
ChemSpider 2D Image | 1-[(2Z)-2-{[(Z)-{1-[(2E)-2-{[(1E)-2-Amino-1-hydroxy-3-methyl-1-buten-1-yl]imino}-1-hydroxypropyl]-2-pyrrolidinylidene}(hydroxy)methyl]imino}-1-hydroxy-3-phenylpropyl]-N-(1,1,5,5-tetrahydroxy-1,4-penta dien-2-yl)prolinamide | C32H46N6O9

1-[(2Z)-2-{[(Z)-{1-[(2E)-2-{[(1E)-2-Amino-1-hydroxy-3-methyl-1-buten-1-yl]imino}-1-hydroxypropyl]-2-pyrrolidinylidene}(hydroxy)methyl]imino}-1-hydroxy-3-phenylpropyl]-N-(1,1,5,5-tetrahydroxy-1,4-penta dien-2-yl)prolinamide

  • Molecular FormulaC32H46N6O9
  • Average mass658.742 Da
  • Monoisotopic mass658.332642 Da
  • ChemSpider ID95638480

More details:

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

1-[(2Z)-2-{[(Z)-{1-[(2E)-2-{[(1E)-2-Amino-1-hydroxy-3-methyl-1-buten-1-yl]imino}-1-hydroxypropyl]-2-pyrrolidinyliden}(hydroxy)methyl]imino}-1-hydroxy-3-phenylpropyl]-N-(1,1,5,5-tetrahydroxy-1,4-pentad ien-2-yl)prolinamid [German] [ACD/IUPAC Name]
1-[(2Z)-2-{[(Z)-{1-[(2E)-2-{[(1E)-2-Amino-1-hydroxy-3-methyl-1-buten-1-yl]imino}-1-hydroxypropyl]-2-pyrrolidinylidene}(hydroxy)methyl]imino}-1-hydroxy-3-phenylpropyl]-N-(1,1,5,5-tetrahydroxy-1,4-penta dien-2-yl)prolinamide [ACD/IUPAC Name]
1-[(2Z)-2-{[(Z)-{1-[(2E)-2-{[(1E)-2-Amino-1-hydroxy-3-méthyl-1-butén-1-yl]imino}-1-hydroxypropyl]-2-pyrrolidinylidène}(hydroxy)méthyl]imino}-1-hydroxy-3-phénylpropyl]-N-(1,1,5,5-tétrahydroxy-1,4-penta dién-2-yl)prolinamide [French] [ACD/IUPAC Name]
2-Pyrrolidinecarboxamide, 1-[(2Z)-2-[[(Z)-[1-[(2E)-2-[[(1E)-2-amino-1-hydroxy-3-methyl-1-buten-1-yl]imino]-1-hydroxypropyl]-2-pyrrolidinylidene]hydroxymethyl]imino]-1-hydroxy-3-phenylpropyl]-N-[1-(dih ydroxymethylene)-4,4-dihydroxy-3-buten-1-yl]- [ACD/Index Name]

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

Density: 1.4±0.1 g/cm3
Boiling Point: 945.3±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.3 mmHg at 25°C
Enthalpy of Vaporization: 144.1±3.0 kJ/mol
Flash Point: 525.5±34.3 °C
Index of Refraction: 1.642
Molar Refractivity: 168.5±0.5 cm3
#H bond acceptors: 15
#H bond donors: 11
#Freely Rotating Bonds: 13
#Rule of 5 Violations: 4
ACD/LogP: 6.97
ACD/LogD (pH 5.5): -1.09
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -1.11
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 248 Å2
Polarizability: 66.8±0.5 10-24cm3
Surface Tension: 58.3±7.0 dyne/cm
Molar Volume: 466.3±7.0 cm3

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