Found 48 results

Search term: MF = 'C_{33}H_{50}O_{8}'
ChemSpider 2D Image | (2aR,3R,5S,5aR,6aR,8S,9aR,10aS,10bR,10cR)-3-Methoxy-6-(2-methoxy-2-oxoethyl)-2a,5a,6a,7-tetramethyl-8-[(3S)-tetrahydro-3-furanyl]-2a,4,5,5a,6,6a,8,9,9a,10a,10b,10c-dodecahydro-2H,3H-cyclopenta[b]furo[ 2',3',4':4,5]naphtho[2,3-d]furan-5-yl 2-methylbutanoate | C33H50O8

(2aR,3R,5S,5aR,6aR,8S,9aR,10aS,10bR,10cR)-3-Methoxy-6-(2-methoxy-2-oxoethyl)-2a,5a,6a,7-tetramethyl-8-[(3S)-tetrahydro-3-furanyl]-2a,4,5,5a,6,6a,8,9,9a,10a,10b,10c-dodecahydro-2H,3H-cyclopenta[b]furo[ 2',3',4':4,5]naphtho[2,3-d]furan-5-yl 2-methylbutanoate

  • Molecular FormulaC33H50O8
  • Average mass574.745 Da
  • Monoisotopic mass574.350586 Da
  • ChemSpider ID156674

  • defined stereocentres - 10 of 13 defined stereocentres

More details:

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

(2aR,3R,5S,5aR,6aR,8S,9aR,10aS,10bR,10cR)-3-Methoxy-6-(2-methoxy-2-oxoethyl)-2a,5a,6a,7-tetramethyl-8-[(3S)-tetrahydro-3-furanyl]-2a,4,5,5a,6,6a,8,9,9a,10a,10b,10c-dodecahydro-2H,3H-cyclopenta[b]furo[ 2',3',4':4,5]naphtho[2,3-d]furan-5-yl 2-methylbutanoate [ACD/IUPAC Name]
(2aR,3R,5S,5aR,6aR,8S,9aR,10aS,10bR,10cR)-3-Methoxy-6-(2-methoxy-2-oxoethyl)-2a,5a,6a,7-tetramethyl-8-[(3S)-tetrahydro-3-furanyl]-2a,4,5,5a,6,6a,8,9,9a,10a,10b,10c-dodecahydro-2H,3H-cyclopenta[b]furo[ 2',3',4':4,5]naphtho[2,3-d]furan-5-yl-2-methylbutanoat [German] [ACD/IUPAC Name]
2H,3H-Cyclopenta[d]naphtho[2,3-b:1,8-b'c']difuran-6-acetic acid, 2a,4,5,5a,6,6a,8,9,9a,10a,10b,10c-dodecahydro-3-methoxy-2a,5a,6a,7-tetramethyl-5-(2-methyl-1-oxobutoxy)-8-[(3S)-tetrahydro-3-furanyl]-, methyl ester, (2aR,3R,5S,5aR,6aR,8S,9aR,10aS,10bR,10cR)- [ACD/Index Name]
2-Méthylbutanoate de (2aR,3R,5S,5aR,6aR,8S,9aR,10aS,10bR,10cR)-3-méthoxy-6-(2-méthoxy-2-oxoéthyl)-2a,5a,6a,7-tétraméthyl-8-[(3S)-tétrahydro-3-furanyl]-2a,4,5,5a,6,6a,8,9,9a,10a,10b,10c-dodécahydro-2H, 3H-cyclopenta[b]furo[2',3',4':4,5]naphto[2,3-d]furan-5-yle [French] [ACD/IUPAC Name]
121232-48-2 [RN]

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

Density: 1.2±0.1 g/cm3
Boiling Point: 610.2±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.7 mmHg at 25°C
Enthalpy of Vaporization: 90.6±3.0 kJ/mol
Flash Point: 251.9±31.5 °C
Index of Refraction: 1.542
Molar Refractivity: 152.5±0.4 cm3
#H bond acceptors: 8
#H bond donors: 0
#Freely Rotating Bonds: 9
#Rule of 5 Violations: 1
ACD/LogP: 3.82
ACD/LogD (pH 5.5): 4.25
ACD/BCF (pH 5.5): 996.58
ACD/KOC (pH 5.5): 4874.55
ACD/LogD (pH 7.4): 4.25
ACD/BCF (pH 7.4): 996.58
ACD/KOC (pH 7.4): 4874.55
Polar Surface Area: 90 Å2
Polarizability: 60.5±0.5 10-24cm3
Surface Tension: 45.1±5.0 dyne/cm
Molar Volume: 484.6±5.0 cm3

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