ChemSpider 2D Image | 4-Hydroxy-6-[(1E,5E,9E,13E,15Z)-4,8,12-trihydroxy-15-(hydroxymethyl)-11,13,17,19,21-pentamethyl-1,5,9,13,15-tricosapentaen-1-yl]tetrahydro-2H-pyran-2-one | C34H56O7

4-Hydroxy-6-[(1E,5E,9E,13E,15Z)-4,8,12-trihydroxy-15-(hydroxymethyl)-11,13,17,19,21-pentamethyl-1,5,9,13,15-tricosapentaen-1-yl]tetrahydro-2H-pyran-2-one

  • Molecular FormulaC34H56O7
  • Average mass576.804 Da
  • Monoisotopic mass576.402588 Da
  • ChemSpider ID4944059

  • Double-bond stereo - Double-bond stereo

More details:

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

2H-Pyran-2-one, tetrahydro-4-hydroxy-6-[(1E,5E,9E,13E,15Z)-4,8,12-trihydroxy-15-(hydroxymethyl)-11,13,17,19,21-pentamethyl-1,5,9,13,15-tricosapentaen-1-yl]- [ACD/Index Name]
4-Hydroxy-6-[(1E,5E,9E,13E,15Z)-4,8,12-trihydroxy-15-(hydroxymethyl)-11,13,17,19,21-pentamethyl-1,5,9,13,15-tricosapentaen-1-yl]tetrahydro-2H-pyran-2-on [German] [ACD/IUPAC Name]
4-Hydroxy-6-[(1E,5E,9E,13E,15Z)-4,8,12-trihydroxy-15-(hydroxymethyl)-11,13,17,19,21-pentamethyl-1,5,9,13,15-tricosapentaen-1-yl]tetrahydro-2H-pyran-2-one [ACD/IUPAC Name]
4-Hydroxy-6-[(1E,5E,9E,13E,15Z)-4,8,12-trihydroxy-15-(hydroxyméthyl)-11,13,17,19,21-pentaméthyl-1,5,9,13,15-tricosapentaén-1-yl]tétrahydro-2H-pyran-2-one [French] [ACD/IUPAC Name]
2H-Pyran-2-one, tetrahydro-4-hydroxy-6-(4,8,12-trihydroxy-15-(hydroxymethyl)-11,13,17,19,21-pentamethyl-1,5,9,13,15-tri-cosapentaenyl)-
4-HYDROXY-6-[(1E,5E,9E,13E,15Z)-4,8,12,16-TETRAHYDROXY-11,13-DIMETHYL-15-(2,4,6-TRIMETHYLOCTYLIDENE)HEXADECA-1,5,9,13-TETRAEN-1-YL]OXAN-2-ONE
83652-16-8 [RN]
Phomenolactone

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

Density: 1.1±0.1 g/cm3
Boiling Point: 754.8±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±5.7 mmHg at 25°C
Enthalpy of Vaporization: 125.5±6.0 kJ/mol
Flash Point: 229.8±26.4 °C
Index of Refraction: 1.557
Molar Refractivity: 168.4±0.3 cm3
#H bond acceptors: 7
#H bond donors: 5
#Freely Rotating Bonds: 18
#Rule of 5 Violations: 2
ACD/LogP: 3.79
ACD/LogD (pH 5.5): 3.98
ACD/BCF (pH 5.5): 619.82
ACD/KOC (pH 5.5): 3469.79
ACD/LogD (pH 7.4): 3.98
ACD/BCF (pH 7.4): 619.82
ACD/KOC (pH 7.4): 3469.79
Polar Surface Area: 127 Å2
Polarizability: 66.7±0.5 10-24cm3
Surface Tension: 49.3±3.0 dyne/cm
Molar Volume: 522.8±3.0 cm3

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