Found 19 results

Search term: MF = 'C_{24}H_{29}ClO_{9}'
ChemSpider 2D Image | (1R,2R,5R,6S,9R,10R,11S,15S,16S,17R)-6-Chloro-9-hydroxy-2,11,15-trimethyl-7-methylene-3,14-dioxo-4,18-dioxatetracyclo[8.7.1.0~1,5~.0~11,16~]octadec-12-ene-15,17-diyl diacetate | C24H29ClO9

(1R,2R,5R,6S,9R,10R,11S,15S,16S,17R)-6-Chloro-9-hydroxy-2,11,15-trimethyl-7-methylene-3,14-dioxo-4,18-dioxatetracyclo[8.7.1.01,5.011,16]octadec-12-ene-15,17-diyl diacetate

  • Molecular FormulaC24H29ClO9
  • Average mass496.935 Da
  • Monoisotopic mass496.150024 Da
  • ChemSpider ID29216416

  • defined stereocentres - 10 of 10 defined stereocentres

More details:

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

(1R,2R,5R,6S,9R,10R,11S,15S,16S,17R)-6-Chlor-9-hydroxy-2,11,15-trimethyl-7-methylen-3,14-dioxo-4,18-dioxatetracyclo[8.7.1.01,5.011,16]octadec-12-en-15,17-diyl-diacetat [German] [ACD/IUPAC Name]
(1R,2R,5R,6S,9R,10R,11S,15S,16S,17R)-6-Chloro-9-hydroxy-2,11,15-trimethyl-7-methylene-3,14-dioxo-4,18-dioxatetracyclo[8.7.1.01,5.011,16]octadec-12-ene-15,17-diyl diacetate [ACD/IUPAC Name]
5H-8,13a-Epoxybenzo[4,5]cyclodeca[1,2-b]furan-2,11(1H,12H)-dione, 12,13-bis(acetyloxy)-4-chloro-3a,4,6,7,8,8a,12a,13-octahydro-7-hydroxy-1,8a,12-trimethyl-5-methylene-, (1R,3aR,4S,7R,8R,8aS,12S,12aS,1 3R,13aR)- [ACD/Index Name]
Diacétate de (1R,2R,5R,6S,9R,10R,11S,15S,16S,17R)-6-chloro-9-hydroxy-2,11,15-triméthyl-7-méthylène-3,14-dioxo-4,18-dioxatétracyclo[8.7.1.01,5.011,16]octadéc-12-ène-15,17-diyle [French] [ACD/IUPAC Name]
erythrolide E

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

Density: 1.4±0.1 g/cm3
Boiling Point: 658.4±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±4.5 mmHg at 25°C
Enthalpy of Vaporization: 111.0±6.0 kJ/mol
Flash Point: 352.0±31.5 °C
Index of Refraction: 1.568
Molar Refractivity: 118.1±0.4 cm3
#H bond acceptors: 9
#H bond donors: 1
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 0
ACD/LogP: 1.85
ACD/LogD (pH 5.5): 2.12
ACD/BCF (pH 5.5): 23.84
ACD/KOC (pH 5.5): 336.95
ACD/LogD (pH 7.4): 2.12
ACD/BCF (pH 7.4): 23.84
ACD/KOC (pH 7.4): 336.95
Polar Surface Area: 125 Å2
Polarizability: 46.8±0.5 10-24cm3
Surface Tension: 54.0±5.0 dyne/cm
Molar Volume: 361.3±5.0 cm3

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