ChemSpider 2D Image | Minosaminomycin | C25H46N8O10

Minosaminomycin

  • Molecular FormulaC25H46N8O10
  • Average mass618.680 Da
  • Monoisotopic mass618.333679 Da
  • ChemSpider ID30791546

  • defined stereocentres - 13 of 13 defined stereocentres

More details:

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

(2S)-2-({[(2S)-3-[(4R)-2-Amino-4,5-dihydro-1H-imidazol-4-yl]-1-{[(1S,2S,3R,4S,5S,6S)-4-{[(2R,3S,5S,6R)-3,5-diamino-6-methyltetrahydro-2H-pyran-2-yl]oxy}-2,3,5,6-tetrahydroxycyclohexyl]amino}-1-oxo-2-p ropanyl]carbamoyl}amino)-4-methylpentanoic acid [ACD/IUPAC Name]
(2S)-2-({[(2S)-3-[(4R)-2-Amino-4,5-dihydro-1H-imidazol-4-yl]-1-{[(1S,2S,3R,4S,5S,6S)-4-{[(2R,3S,5S,6R)-3,5-diamino-6-methyltetrahydro-2H-pyran-2-yl]oxy}-2,3,5,6-tetrahydroxycyclohexyl]amino}-1-oxo-2-p ropanyl]carbamoyl}amino)-4-methylpentansäure [German] [ACD/IUPAC Name]
Acide (2S)-2-({[(2S)-3-[(4R)-2-amino-4,5-dihydro-1H-imidazol-4-yl]-1-{[(1S,2S,3R,4S,5S,6S)-4-{[(2R,3S,5S,6R)-3,5-diamino-6-méthyltétrahydro-2H-pyran-2-yl]oxy}-2,3,5,6-tétrahydroxycyclohexyl]amino}-1-o xo-2-propanyl]carbamoyl}amino)-4-méthylpentanoïque [French] [ACD/IUPAC Name]
Minosaminomycin
α-D-arabino-Hexopyranoside, (1β,2α,3α,4α,5β,6α)-4-[[(2S)-2-[[[[(1S)-1-carboxy-3-methylbutyl]amino]carbonyl]amino]-3-[(4R)-2-imino-4-imidazolidinyl]-1-oxopropyl]amino]-2,3,5,6 -tetrahydroxycyclohexyl 2,4-diamino-2,3,4,6-tetradeoxy- [ACD/Index Name]
51746-09-9 [RN]

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

Density: 1.8±0.1 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.730
Molar Refractivity: 140.2±0.5 cm3
#H bond acceptors: 18
#H bond donors: 15
#Freely Rotating Bonds: 11
#Rule of 5 Violations: 3
ACD/LogP: -1.55
ACD/LogD (pH 5.5): -6.71
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -6.01
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 307 Å2
Polarizability: 55.6±0.5 10-24cm3
Surface Tension: 76.0±7.0 dyne/cm
Molar Volume: 351.1±7.0 cm3

Click to predict properties on the Chemicalize site


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