ChemSpider 2D Image | (4S,5R,6S,8R,9E,11E,14S,15E)-4,6,8,10,14-Pentamethyl-7-oxo-16-[(2R)-6-oxo-3,6-dihydro-2H-pyran-2-yl]-9,11,15-hexadecatrien-5-yl 6-deoxy-4-O-(2,6-dideoxy-alpha-L-lyxo-hexopyranosyl)-beta-D-gulopyranosi de | C38H60O11

(4S,5R,6S,8R,9E,11E,14S,15E)-4,6,8,10,14-Pentamethyl-7-oxo-16-[(2R)-6-oxo-3,6-dihydro-2H-pyran-2-yl]-9,11,15-hexadecatrien-5-yl 6-deoxy-4-O-(2,6-dideoxy-α-L-lyxo-hexopyranosyl)-β-D-gulopyranosi de

  • Molecular FormulaC38H60O11
  • Average mass692.876 Da
  • Monoisotopic mass692.413574 Da
  • ChemSpider ID8570353

  • Double-bond stereo - Double-bond stereo

    defined stereocentres - 15 of 15 defined stereocentres

More details:

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

(4S,5R,6S,8R,9E,11E,14S,15E)-4,6,8,10,14-Pentamethyl-7-oxo-16-[(2R)-6-oxo-3,6-dihydro-2H-pyran-2-yl]-9,11,15-hexadecatrien-5-yl 6-deoxy-4-O-(2,6-dideoxy-α-L-lyxo-hexopyranosyl)-β-D-gulopyranosi de [ACD/IUPAC Name]
(4S,5R,6S,8R,9E,11E,14S,15E)-4,6,8,10,14-Pentamethyl-7-oxo-16-[(2R)-6-oxo-3,6-dihydro-2H-pyran-2-yl]-9,11,15-hexadecatrien-5-yl-6-desoxy-4-O-(2,6-didesoxy-α-L-lyxo-hexopyranosyl)-β-D-gulopyrano sid [German] [ACD/IUPAC Name]
2H-Pyran-2-one, 6-[(1E,3S,5E,7E,9R,11S,12R,13S)-12-[[6-deoxy-4-O-(2,6-dideoxy-α-L-lyxo-hexopyranosyl)-β-D-gulopyranosyl]oxy]-3,7,9,11,13-pentamethyl-10-oxo-1,5,7-hexadecatrien-1-yl]-5,6-dihydro -, (6R)- [ACD/Index Name]
6-Désoxy-4-O-(2,6-didésoxy-α-L-lyxo-hexopyranosyl)-β-D-gulopyranoside de (4S,5R,6S,8R,9E,11E,14S,15E)-4,6,8,10,14-pentaméthyl-7-oxo-16-[(2R)-6-oxo-3,6-dihydro-2H-pyran-2-yl]-9,11,15-hexadécatri én-5-yle [French] [ACD/IUPAC Name]
Lycogalinoside A

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

Density: 1.2±0.1 g/cm3
Boiling Point: 842.4±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.6 mmHg at 25°C
Enthalpy of Vaporization: 139.2±6.0 kJ/mol
Flash Point: 251.6±27.8 °C
Index of Refraction: 1.548
Molar Refractivity: 186.0±0.4 cm3
#H bond acceptors: 11
#H bond donors: 4
#Freely Rotating Bonds: 16
#Rule of 5 Violations: 2
ACD/LogP: 4.89
ACD/LogD (pH 5.5): 3.80
ACD/BCF (pH 5.5): 458.55
ACD/KOC (pH 5.5): 2796.55
ACD/LogD (pH 7.4): 3.80
ACD/BCF (pH 7.4): 458.55
ACD/KOC (pH 7.4): 2796.53
Polar Surface Area: 161 Å2
Polarizability: 73.8±0.5 10-24cm3
Surface Tension: 50.3±5.0 dyne/cm
Molar Volume: 585.9±5.0 cm3

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