Found 54 results

Search term: MF = 'C_{30}H_{44}N_{2}O_{8}'
ChemSpider 2D Image | (3R,4S,4aS,9bS)-3-[6-Heptenoyl(3-isopropoxypropyl)amino]-4-hydroxy-N-(2-hydroxyethyl)-8-(hydroxymethyl)-6-methoxy-3,4,4a,9b-tetrahydrodibenzo[b,d]furan-1-carboxamide | C30H44N2O8

(3R,4S,4aS,9bS)-3-[6-Heptenoyl(3-isopropoxypropyl)amino]-4-hydroxy-N-(2-hydroxyethyl)-8-(hydroxymethyl)-6-methoxy-3,4,4a,9b-tetrahydrodibenzo[b,d]furan-1-carboxamide

  • Molecular FormulaC30H44N2O8
  • Average mass560.679 Da
  • Monoisotopic mass560.309753 Da
  • ChemSpider ID5153680

  • defined stereocentres - 4 of 4 defined stereocentres

More details:

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

(3R,4S,4aS,9bS)-3-[6-Heptenoyl(3-isopropoxypropyl)amino]-4-hydroxy-N-(2-hydroxyethyl)-8-(hydroxymethyl)-6-methoxy-3,4,4a,9b-tetrahydrodibenzo[b,d]furan-1-carboxamid [German] [ACD/IUPAC Name]
(3R,4S,4aS,9bS)-3-[6-Heptenoyl(3-isopropoxypropyl)amino]-4-hydroxy-N-(2-hydroxyethyl)-8-(hydroxymethyl)-6-methoxy-3,4,4a,9b-tetrahydrodibenzo[b,d]furan-1-carboxamide [ACD/IUPAC Name]
(3R,4S,4aS,9bS)-3-[6-Heptenoyl(3-isopropoxypropyl)amino]-4-hydroxy-N-(2-hydroxyéthyl)-8-(hydroxyméthyl)-6-méthoxy-3,4,4a,9b-tétrahydrodibenzo[b,d]furane-1-carboxamide [French] [ACD/IUPAC Name]
1-Dibenzofurancarboxamide, 3,4,4a,9b-tetrahydro-4-hydroxy-N-(2-hydroxyethyl)-8-(hydroxymethyl)-6-methoxy-3-[[3-(1-methylethoxy)propyl](1-oxo-6-hepten-1-yl)amino]-, (3R,4S,4aS,9bS)- [ACD/Index Name]
SAH1_004756

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

Density: 1.2±0.1 g/cm3
Boiling Point: 793.0±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.9 mmHg at 25°C
Enthalpy of Vaporization: 121.0±3.0 kJ/mol
Flash Point: 433.4±32.9 °C
Index of Refraction: 1.583
Molar Refractivity: 150.7±0.4 cm3
#H bond acceptors: 10
#H bond donors: 4
#Freely Rotating Bonds: 16
#Rule of 5 Violations: 2
ACD/LogP: 1.20
ACD/LogD (pH 5.5): 1.69
ACD/BCF (pH 5.5): 11.41
ACD/KOC (pH 5.5): 198.86
ACD/LogD (pH 7.4): 1.69
ACD/BCF (pH 7.4): 11.41
ACD/KOC (pH 7.4): 198.86
Polar Surface Area: 138 Å2
Polarizability: 59.8±0.5 10-24cm3
Surface Tension: 57.4±5.0 dyne/cm
Molar Volume: 450.7±5.0 cm3

Click to predict properties on the Chemicalize site


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