ChemSpider 2D Image | lymecycline | C29H38N4O10

lymecycline

  • Molecular FormulaC29H38N4O10
  • Average mass602.633 Da
  • Monoisotopic mass602.258789 Da
  • ChemSpider ID20121315
  • defined stereocentres - 6 of 6 defined stereocentres


More details:






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

1679
213-592-2 [EINECS]
7D6EM3S13P
limeciclina [Spanish] [INN]
L-Lysine, N6-[[[[(4S,4aS,5aS,6S,12aS)-4-(dimethylamino)-1,4,4a,5,5a,6,11,12a-octahydro-3,6,10,12,12a-pentahydroxy-6-methyl-1,11-dioxo-2-naphthacenyl]carbonyl]amino]methyl]- [ACD/Index Name]
L-Lysine, N6-(((((4S,4aS,5aS,6S,12aS)-4-(dimethylamino)-1,4,4a,5,5a,6,11,12a-octahydro-3,6,10,12,12a-pentahydroxy-6-methyl-1,11-dioxo-2-naphthacenyl)carbonyl)amino)methyl)-
lymecycline [INN] [Wiki]
lymécycline [French] [INN]
lymecyclinum [Latin] [INN]
N6-[({[(4S,4aS,5aS,6S,12aS)-4-(Dimethylamino)-3,6,10,12,12a-pentahydroxy-6-methyl-1,11-dioxo-1,4,4a,5,5a,6,11,12a-octahydro-2-tetracenyl]carbonyl}amino)methyl]-L-lysin [German] [ACD/IUPAC Name]
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  • Miscellaneous
    • Safety:

      J01AA04 Wikidata Q897051
    • Chemical Class:

      A tetracycline-based broad-spectrum antibiotic. It is approximately 5000 times more soluble than tetracycline base and is unique amongst tetracyclines in that it is absorbed by the "active transport" process across the intestinal wall. ChEBI CHEBI:59040
    • Drug Status:

      approved BIONET-Key Organics KS-1366

Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module

Density: 1.5±0.1 g/cm3
Boiling Point: 928.1±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.3 mmHg at 25°C
Enthalpy of Vaporization: 141.4±3.0 kJ/mol
Flash Point: 515.1±34.3 °C
Index of Refraction: 1.693
Molar Refractivity: 150.4±0.4 cm3
#H bond acceptors: 14
#H bond donors: 10
#Freely Rotating Bonds: 10
#Rule of 5 Violations: 3
ACD/LogP: -1.70
ACD/LogD (pH 5.5): -5.68
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -4.74
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 243 Å2
Polarizability: 59.6±0.5 10-24cm3
Surface Tension: 91.6±5.0 dyne/cm
Molar Volume: 392.2±5.0 cm3

Click to predict properties on the Chemicalize site





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