ChemSpider 2D Image | 4-(Dimethylamino)-2-({14-ethyl-7,12,13-trihydroxy-4-[(5-hydroxy-4-methoxy-4,6-dimethyltetrahydro-2H-pyran-2-yl)oxy]-3,5,7,9,11,13-hexamethyl-2,10-dioxooxacyclotetradecan-6-yl}oxy)-6-methyltetrahydro-2 H-pyran-3-yl 2-furoate | C42H69NO15

4-(Dimethylamino)-2-({14-ethyl-7,12,13-trihydroxy-4-[(5-hydroxy-4-methoxy-4,6-dimethyltetrahydro-2H-pyran-2-yl)oxy]-3,5,7,9,11,13-hexamethyl-2,10-dioxooxacyclotetradecan-6-yl}oxy)-6-methyltetrahydro-2 H-pyran-3-yl 2-furoate

  • Molecular FormulaC42H69NO15
  • Average mass827.995 Da
  • Monoisotopic mass827.466736 Da
  • ChemSpider ID2298728

More details:

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

2-Furoate de 4-(diméthylamino)-2-({14-éthyl-7,12,13-trihydroxy-4-[(5-hydroxy-4-méthoxy-4,6-diméthyltétrahydro-2H-pyran-2-yl)oxy]-3,5,7,9,11,13-hexaméthyl-2,10-dioxooxacyclotétradécan-6-yl}oxy)-6-méthy ltétrahydro-2H-pyran-3-yle [French] [ACD/IUPAC Name]
4-(Dimethylamino)-2-({14-ethyl-7,12,13-trihydroxy-4-[(5-hydroxy-4-methoxy-4,6-dimethyltetrahydro-2H-pyran-2-yl)oxy]-3,5,7,9,11,13-hexamethyl-2,10-dioxooxacyclotetradecan-6-yl}oxy)-6-methyltetrahydro-2 H-pyran-3-yl 2-furoate [ACD/IUPAC Name]
4-(Dimethylamino)-2-({14-ethyl-7,12,13-trihydroxy-4-[(5-hydroxy-4-methoxy-4,6-dimethyltetrahydro-2H-pyran-2-yl)oxy]-3,5,7,9,11,13-hexamethyl-2,10-dioxooxacyclotetradecan-6-yl}oxy)-6-methyltetrahydro-2 H-pyran-3-yl-2-furoat [German] [ACD/IUPAC Name]
3-Cladinosyl-5-(2'-O-(2-furoyl))desoaminylerythronolide A
4-18-00-07420 [Beilstein]
60847-79-2 [RN]
Erythromycin, 2'-(2-furancarboxylate)

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

BRN 0077313 [DBID]

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

Density: 1.2±0.1 g/cm3
Boiling Point: 869.7±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.3 mmHg at 25°C
Enthalpy of Vaporization: 132.4±3.0 kJ/mol
Flash Point: 479.8±34.3 °C
Index of Refraction: 1.544
Molar Refractivity: 211.3±0.4 cm3
#H bond acceptors: 16
#H bond donors: 4
#Freely Rotating Bonds: 10
#Rule of 5 Violations: 2
ACD/LogP: 4.36
ACD/LogD (pH 5.5): 1.71
ACD/BCF (pH 5.5): 3.80
ACD/KOC (pH 5.5): 23.98
ACD/LogD (pH 7.4): 3.34
ACD/BCF (pH 7.4): 165.29
ACD/KOC (pH 7.4): 1044.15
Polar Surface Area: 213 Å2
Polarizability: 83.8±0.5 10-24cm3
Surface Tension: 52.8±5.0 dyne/cm
Molar Volume: 668.9±5.0 cm3

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