ChemSpider 2D Image | CSID:8009568 | C73H88Cl2N10O26

  • Molecular FormulaC73H88Cl2N10O26
  • Average mass1592.437 Da
  • Monoisotopic mass1590.524780 Da
  • ChemSpider ID8009568

  • defined stereocentres - 19 of 21 defined stereocentres

More details:

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

(1S,2R,18R,19R,22S,25R,28R,40S)-2-{[(2S,5S,6R)-4-Amino-5-hydroxy-4,6-dimethyltetrahydro-2H-pyran-2-yl]oxy}-48-{[(2R,4R,5S,6R)-2-{[(2R,5S,6R)-4-amino-5-hydroxy-4,6-dimethyltetrahydro-2H-pyran-2-yl]oxy} -4,5-dihydroxy-6-(hydroxymethyl)tetrahydro-2H-pyran-2-yl]oxy}-22-(2-amino-2-oxoethyl)-5,15-dichlor-18,32,35,37-tetrahydroxy-19-{[(2R)-4-methyl-2-(methylamino)pentanoyl]amino}-20,23,26,42,44-pentaoxo-7 ,13-dioxa-21,24,27,41,43-pentaazaoctacyclo[2 [German] [ACD/IUPAC Name]
Acide (1S,2R,18R,19R,22S,25R,28R,40S)-2-{[(2S,5S,6R)-4-amino-5-hydroxy-4,6-diméthyltétrahydro-2H-pyran-2-yl]oxy}-48-{[(2R,4R,5S,6R)-2-{[(2R,5S,6R)-4-amino-5-hydroxy-4,6-diméthyltétrahydro-2H-pyran-2-y l]oxy}-4,5-dihydroxy-6-(hydroxyméthyl)tétrahydro-2H-pyran-2-yl]oxy}-22-(2-amino-2-oxoéthyl)-5,15-dichloro-18,32,35,37-tétrahydroxy-19-{[(2R)-4-méthyl-2-(méthylamino)pentanoyl]amino}-20,23,26,42,44-pen taoxo-7,13-dioxa-21,24,27,41,43-pentaazaocta [French] [ACD/IUPAC Name]

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

Density: 1.6±0.1 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.720
Molar Refractivity: 388.3±0.4 cm3
#H bond acceptors: 36
#H bond donors: 23
#Freely Rotating Bonds: 15
#Rule of 5 Violations: 3
ACD/LogP: -0.46
ACD/LogD (pH 5.5): -6.44
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -5.77
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 575 Å2
Polarizability: 153.9±0.5 10-24cm3
Surface Tension: 100.5±5.0 dyne/cm
Molar Volume: 983.1±5.0 cm3

Click to predict properties on the Chemicalize site


Advertisement