Found 41 results

Search term: MF = 'C_{42}H_{59}N_{3}O_{10}'
ChemSpider 2D Image | (3aS,4S,7R,9R,10R,11S,13R,15S,15aR)-4-Ethyl-3a,7,9,11,13,15-hexamethyl-2,6,8,14-tetraoxo-11-{[(2E)-3-(2-quinolinyl)-2-propen-1-yl]oxy}tetradecahydro-2H-oxacyclotetradecino[4,3-d][1,3]oxazol-10-yl 3,4, 6-trideoxy-3-(dimethylamino)-beta-D-xylo-hexopyranoside | C42H59N3O10

(3aS,4S,7R,9R,10R,11S,13R,15S,15aR)-4-Ethyl-3a,7,9,11,13,15-hexamethyl-2,6,8,14-tetraoxo-11-{[(2E)-3-(2-quinolinyl)-2-propen-1-yl]oxy}tetradecahydro-2H-oxacyclotetradecino[4,3-d][1,3]oxazol-10-yl 3,4, 6-trideoxy-3-(dimethylamino)-β-D-xylo-hexopyranoside

  • Molecular FormulaC42H59N3O10
  • Average mass765.932 Da
  • Monoisotopic mass765.420044 Da
  • ChemSpider ID4977363

  • Double-bond stereo - Double-bond stereo

    defined stereocentres - 13 of 13 defined stereocentres

More details:

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

(3aS,4S,7R,9R,10R,11S,13R,15S,15aR)-11-{[(2E)-3-(2-Chinolinyl)-2-propen-1-yl]oxy}-4-ethyl-3a,7,9,11,13,15-hexamethyl-2,6,8,14-tetraoxotetradecahydro-2H-oxacyclotetradecino[4,3-d][1,3]oxazol-10-yl-3,4, ;6-tridesoxy-3-(dimethylamino)-β-D-xylo-hexopyranosid [German] [ACD/IUPAC Name]
(3aS,4S,7R,9R,10R,11S,13R,15S,15aR)-4-Ethyl-3a,7,9,11,13,15-hexamethyl-2,6,8,14-tetraoxo-11-{[(2E)-3-(2-quinolinyl)-2-propen-1-yl]oxy}tetradecahydro-2H-oxacyclotetradecino[4,3-d][1,3]oxazol-10-yl 3,4, ;6-trideoxy-3-(dimethylamino)-β-D-xylo-hexopyranoside [ACD/IUPAC Name]
2H-Oxacyclotetradecino[4,3-d]oxazole-2,6,8,14(1H,7H,9H)-tetrone, 4-ethyloctahydro-3a,7,9,11,13,15-hexamethyl-11-[[(2E)-3-(2-quinolinyl)-2-propen-1-yl]oxy]-10-[[3,4,6-trideoxy-3-(dimethylamino)-β-D- xylo-hexopyranosyl]oxy]-, (3aS,4S,7R,9R,10R,11S,13R,15S,15aR)- [ACD/Index Name]
3,4,6-Tridésoxy-3-(diméthylamino)-β-D-xylo-hexopyranoside de (3aS,4S,7R,9R,10R,11S,13R,15S,15aR)-4-éthyl-3a,7,9,11,13,15-hexaméthyl-2,6,8,14-tétraoxo-11-{[(2E)-3-(2-quinoléinyl)-2-propén-1-yl]oxy}t étradécahydro-2H-oxacyclotétradécino[4,3-d][1,3]oxazol-10-yle [French] [ACD/IUPAC Name]
6-(3-(2-Quinolyl)prop-2-enyloxy)(6S,14S,1R,2R,4R,7R,8R,10R,13R)-7-[(2S,4S,3R,6R)-4-(dimethylamino)-3-hydroxy-6-methylperhydropyran-2-yloxy]-17-aza-13-ethyl-2,4,6,8,10,14-hexamethyl-12,15-dioxabicyclo[12.3.0]heptadecane-3,9,11,16-tetraone
6-O-Substituted-11,12 carbamate ketolide

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

A-223018 [DBID]
AIDS093611 [DBID]
AIDS-093611 [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: 927.1±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.3 mmHg at 25°C
Enthalpy of Vaporization: 141.3±3.0 kJ/mol
Flash Point: 514.5±34.3 °C
Index of Refraction: 1.578
Molar Refractivity: 206.7±0.4 cm3
#H bond acceptors: 13
#H bond donors: 2
#Freely Rotating Bonds: 8
#Rule of 5 Violations: 3
ACD/LogP: 5.24
ACD/LogD (pH 5.5): 2.48
ACD/BCF (pH 5.5): 11.71
ACD/KOC (pH 5.5): 40.76
ACD/LogD (pH 7.4): 4.20
ACD/BCF (pH 7.4): 611.80
ACD/KOC (pH 7.4): 2129.30
Polar Surface Area: 163 Å2
Polarizability: 81.9±0.5 10-24cm3
Surface Tension: 54.2±5.0 dyne/cm
Molar Volume: 622.9±5.0 cm3

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