ChemSpider 2D Image | (3Z,5E,8S,9E,11Z,14S,16R,17E,24R)-14,16-Dihydroxy-24-methyl-2-oxooxacyclotetracosa-3,5,9,11,17-pentaen-8-yl beta-L-glucopyranoside | C30H46O10

(3Z,5E,8S,9E,11Z,14S,16R,17E,24R)-14,16-Dihydroxy-24-methyl-2-oxooxacyclotetracosa-3,5,9,11,17-pentaen-8-yl β-L-glucopyranoside

  • Molecular FormulaC30H46O10
  • Average mass566.680 Da
  • Monoisotopic mass566.309082 Da
  • ChemSpider ID31112947

  • Double-bond stereo - Double-bond stereo

    defined stereocentres - 9 of 9 defined stereocentres

More details:

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

(3Z,5E,8S,9E,11Z,14S,16R,17E,24R)-14,16-Dihydroxy-24-methyl-2-oxooxacyclotetracosa-3,5,9,11,17-pentaen-8-yl β-L-glucopyranoside [ACD/IUPAC Name]
(3Z,5E,8S,9E,11Z,14S,16R,17E,24R)-14,16-Dihydroxy-24-methyl-2-oxooxacyclotetracosa-3,5,9,11,17-pentaen-8-yl-β-L-glucopyranosid [German] [ACD/IUPAC Name]
Oxacyclotetracosa-3,5,9,11,17-pentaen-2-one, 8-(β-L-glucopyranosyloxy)-14,16-dihydroxy-24-methyl-, (3Z,5E,8S,9E,11Z,14S,16R,17E,24R)- [ACD/Index Name]
β-L-Glucopyranoside de (3Z,5E,8S,9E,11Z,14S,16R,17E,24R)-14,16-dihydroxy-24-méthyl-2-oxooxacyclotétracosa-3,5,9,11,17-pentaén-8-yle [French] [ACD/IUPAC Name]
1428653-23-9 [RN]
Gageomacrolactin 3

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

Density: 1.3±0.1 g/cm3
Boiling Point: 814.7±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.6 mmHg at 25°C
Enthalpy of Vaporization: 134.8±6.0 kJ/mol
Flash Point: 259.6±27.8 °C
Index of Refraction: 1.582
Molar Refractivity: 150.8±0.4 cm3
#H bond acceptors: 10
#H bond donors: 6
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 3
ACD/LogP: 1.44
ACD/LogD (pH 5.5): 1.26
ACD/BCF (pH 5.5): 5.34
ACD/KOC (pH 5.5): 115.52
ACD/LogD (pH 7.4): 1.26
ACD/BCF (pH 7.4): 5.34
ACD/KOC (pH 7.4): 115.52
Polar Surface Area: 166 Å2
Polarizability: 59.8±0.5 10-24cm3
Surface Tension: 60.5±5.0 dyne/cm
Molar Volume: 452.1±5.0 cm3

Click to predict properties on the Chemicalize site


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