ChemSpider 2D Image | Pristinamycin IIB | C28H37N3O7

Pristinamycin IIB

  • Molecular FormulaC28H37N3O7
  • Average mass527.609 Da
  • Monoisotopic mass527.263123 Da
  • ChemSpider ID4952854

  • Double-bond stereo - Double-bond stereo

    defined stereocentres - 4 of 4 defined stereocentres

More details:

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

(10S,18E,20R,21R,24S)-10-Hydroxy-21-isopropyl-12,20-dimethyl-5,22-dioxa-1,16,28-triazatricyclo[22.2.1.13,6]octacosa-3,6(28),11,13,18-pentaen-2,8,17,23-tetron [German] [ACD/IUPAC Name]
(10S,18E,20R,21R,24S)-10-Hydroxy-21-isopropyl-12,20-dimethyl-5,22-dioxa-1,16,28-triazatricyclo[22.2.1.13,6]octacosa-3,6(28),11,13,18-pentaene-2,8,17,23-tetrone [ACD/IUPAC Name]
(10S,18E,20R,21R,24S)-10-Hydroxy-21-isopropyl-12,20-diméthyl-5,22-dioxa-1,16,28-triazatricyclo[22.2.1.13,6]octacosa-3,6(28),11,13,18-pentaène-2,8,17,23-tétrone [French] [ACD/IUPAC Name]
21102-49-8 [RN]
5,22-Dioxa-1,16,28-triazatricyclo[22.2.1.13,6]octacosa-3,6(28),11,13,18-pentaene-2,8,17,23-tetrone, 10-hydroxy-12,20-dimethyl-21-(1-methylethyl)-, (10S,18E,20R,21R,24S)- [ACD/Index Name]
Pristinamycin IIB [Wiki]
Volpristin [INN]
volpristina [Spanish] [INN]
volpristine [French] [INN]
volpristinum [Latin] [INN]
More...

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

Density: 1.3±0.1 g/cm3
Boiling Point: 809.5±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±3.0 mmHg at 25°C
Enthalpy of Vaporization: 123.4±3.0 kJ/mol
Flash Point: 443.3±34.3 °C
Index of Refraction: 1.575
Molar Refractivity: 139.4±0.4 cm3
#H bond acceptors: 10
#H bond donors: 2
#Freely Rotating Bonds: 1
#Rule of 5 Violations: 2
ACD/LogP: -0.80
ACD/LogD (pH 5.5): 0.28
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 33.74
ACD/LogD (pH 7.4): 0.28
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 33.74
Polar Surface Area: 139 Å2
Polarizability: 55.3±0.5 10-24cm3
Surface Tension: 56.6±5.0 dyne/cm
Molar Volume: 421.7±5.0 cm3

Click to predict properties on the Chemicalize site


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