Found 25 results

Search term: MF = 'C_{37}H_{68}O_{8}'
ChemSpider 2D Image | (3S)-5-(2-Oxopropyl)-3-[(2R,8R,11R)-2,8,11-trihydroxy-11-{(2R,5R)-5-[(1R)-1-hydroxypentadecyl]tetrahydro-2-furanyl}undecyl]dihydro-2(3H)-furanone | C37H68O8

(3S)-5-(2-Oxopropyl)-3-[(2R,8R,11R)-2,8,11-trihydroxy-11-{(2R,5R)-5-[(1R)-1-hydroxypentadecyl]tetrahydro-2-furanyl}undecyl]dihydro-2(3H)-furanone

  • Molecular FormulaC37H68O8
  • Average mass640.931 Da
  • Monoisotopic mass640.491394 Da
  • ChemSpider ID8253441

  • defined stereocentres - 7 of 8 defined stereocentres

More details:

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

(3S)-5-(2-Oxopropyl)-3-[(2R,8R,11R)-2,8,11-trihydroxy-11-{(2R,5R)-5-[(1R)-1-hydroxypentadecyl]tetrahydro-2-furanyl}undecyl]dihydro-2(3H)-furanon [German] [ACD/IUPAC Name]
(3S)-5-(2-Oxopropyl)-3-[(2R,8R,11R)-2,8,11-trihydroxy-11-{(2R,5R)-5-[(1R)-1-hydroxypentadecyl]tetrahydro-2-furanyl}undecyl]dihydro-2(3H)-furanone [ACD/IUPAC Name]
(3S)-5-(2-Oxopropyl)-3-[(2R,8R,11R)-2,8,11-trihydroxy-11-{(2R,5R)-5-[(1R)-1-hydroxypentadécyl]tétrahydro-2-furanyl}undécyl]dihydro-2(3H)-furanone [French] [ACD/IUPAC Name]
2(3H)-Furanone, dihydro-5-(2-oxopropyl)-3-[(2R,8R,11R)-2,8,11-trihydroxy-11-[(2R,5R)-tetrahydro-5-[(1R)-1-hydroxypentadecyl]-2-furanyl]undecyl]-, (3S)- [ACD/Index Name]

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

Density: 1.1±0.1 g/cm3
Boiling Point: 786.1±35.0 °C at 760 mmHg
Vapour Pressure: 0.0±6.2 mmHg at 25°C
Enthalpy of Vaporization: 130.3±6.0 kJ/mol
Flash Point: 232.4±19.4 °C
Index of Refraction: 1.499
Molar Refractivity: 178.7±0.3 cm3
#H bond acceptors: 8
#H bond donors: 4
#Freely Rotating Bonds: 28
#Rule of 5 Violations: 2
ACD/LogP: 5.44
ACD/LogD (pH 5.5): 6.15
ACD/BCF (pH 5.5): 27629.13
ACD/KOC (pH 5.5): 52567.28
ACD/LogD (pH 7.4): 6.15
ACD/BCF (pH 7.4): 27629.13
ACD/KOC (pH 7.4): 52567.28
Polar Surface Area: 134 Å2
Polarizability: 70.8±0.5 10-24cm3
Surface Tension: 42.8±3.0 dyne/cm
Molar Volume: 608.4±3.0 cm3

Click to predict properties on the Chemicalize site


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