Found 1 result

Search term: 78440975 (Found by CSID)
ChemSpider 2D Image | (3S,4S,5S,6R)-5-Methoxy-4-[(2S,3R)-2-methyl-3-(3-methyl-2-buten-1-yl)-2-oxiranyl]-1-oxaspiro[2.5]oct-6-yl methyl (2Z,4E,6E,8E)-2,4,6,8-decatetraenedioate | C27H36O7

(3S,4S,5S,6R)-5-Methoxy-4-[(2S,3R)-2-methyl-3-(3-methyl-2-buten-1-yl)-2-oxiranyl]-1-oxaspiro[2.5]oct-6-yl methyl (2Z,4E,6E,8E)-2,4,6,8-decatetraenedioate

  • Molecular FormulaC27H36O7
  • Average mass472.570 Da
  • Monoisotopic mass472.246094 Da
  • ChemSpider ID78440975

  • Double-bond stereo - Double-bond stereo

    defined stereocentres - 5 of 6 defined stereocentres

More details:

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

(2Z,4E,6E,8E)-2,4,6,8-Décatétraènedioate de (3S,4S,5S,6R)-5-méthoxy-4-[(2S,3R)-2-méthyl-3-(3-méthyl-2-butén-1-yl)-2-oxiranyl]-1-oxaspiro[2.5]oct-6-yle et de méthyle [French] [ACD/IUPAC Name]
(3S,4S,5S,6R)-5-Methoxy-4-[(2S,3R)-2-methyl-3-(3-methyl-2-buten-1-yl)-2-oxiranyl]-1-oxaspiro[2.5]oct-6-yl methyl (2Z,4E,6E,8E)-2,4,6,8-decatetraenedioate [ACD/IUPAC Name]
(3S,4S,5S,6R)-5-Methoxy-4-[(2S,3R)-2-methyl-3-(3-methyl-2-buten-1-yl)-2-oxiranyl]-1-oxaspiro[2.5]oct-6-yl-methyl-(2Z,4E,6E,8E)-2,4,6,8-decatetraendioat [German] [ACD/IUPAC Name]
2,4,6,8-Decatetraenedioic acid, (3S,4S,5S,6R)-5-methoxy-4-[(2S,3R)-2-methyl-3-(3-methyl-2-buten-1-yl)oxiranyl]-1-oxaspiro[2.5]oct-6-yl methyl ester, (2Z,4E,6E,8E)- [ACD/Index Name]
Cis-Fumagillin

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

Density: 1.2±0.1 g/cm3
Boiling Point: 584.2±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.6 mmHg at 25°C
Enthalpy of Vaporization: 87.3±3.0 kJ/mol
Flash Point: 247.3±30.2 °C
Index of Refraction: 1.546
Molar Refractivity: 129.1±0.4 cm3
#H bond acceptors: 7
#H bond donors: 0
#Freely Rotating Bonds: 12
#Rule of 5 Violations: 0
ACD/LogP: 3.78
ACD/LogD (pH 5.5): 3.78
ACD/BCF (pH 5.5): 436.54
ACD/KOC (pH 5.5): 2699.79
ACD/LogD (pH 7.4): 3.78
ACD/BCF (pH 7.4): 436.54
ACD/KOC (pH 7.4): 2699.79
Polar Surface Area: 87 Å2
Polarizability: 51.2±0.5 10-24cm3
Surface Tension: 44.5±5.0 dyne/cm
Molar Volume: 408.0±5.0 cm3

Click to predict properties on the Chemicalize site


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