ChemSpider 2D Image | (11E,13E)-6-[(4,5-Dihydroxy-4,6-dimethyltetrahydro-2H-pyran-2-yl)oxy]-7-ethyl-4,10-dihydroxy-5-methoxy-9,16-dimethyloxacyclohexadeca-11,13-dien-2-one | C27H46O9

(11E,13E)-6-[(4,5-Dihydroxy-4,6-dimethyltetrahydro-2H-pyran-2-yl)oxy]-7-ethyl-4,10-dihydroxy-5-methoxy-9,16-dimethyloxacyclohexadeca-11,13-dien-2-one

  • Molecular FormulaC27H46O9
  • Average mass514.649 Da
  • Monoisotopic mass514.314209 Da
  • ChemSpider ID4532250

  • Double-bond stereo - Double-bond stereo

More details:

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

(11E,13E)-6-[(4,5-Dihydroxy-4,6-dimethyltetrahydro-2H-pyran-2-yl)oxy]-7-ethyl-4,10-dihydroxy-5-methoxy-9,16-dimethyloxacyclohexadeca-11,13-dien-2-on [German] [ACD/IUPAC Name]
(11E,13E)-6-[(4,5-Dihydroxy-4,6-dimethyltetrahydro-2H-pyran-2-yl)oxy]-7-ethyl-4,10-dihydroxy-5-methoxy-9,16-dimethyloxacyclohexadeca-11,13-dien-2-one [ACD/IUPAC Name]
(11E,13E)-6-[(4,5-Dihydroxy-4,6-diméthyltétrahydro-2H-pyran-2-yl)oxy]-7-éthyl-4,10-dihydroxy-5-méthoxy-9,16-diméthyloxacyclohexadéca-11,13-dién-2-one [French] [ACD/IUPAC Name]
75006-00-7 [RN]
PLATENOLIDE II, 5-O- (α-MACROSYL):(MYC-PL-II)
PLATENOLIDE II, 5-O-(α-MACROSYL):(MYC-PL-II)

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

NSC375096 [DBID]

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

Density: 1.2±0.1 g/cm3
Boiling Point: 685.8±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±4.8 mmHg at 25°C
Enthalpy of Vaporization: 115.0±6.0 kJ/mol
Flash Point: 219.0±25.0 °C
Index of Refraction: 1.535
Molar Refractivity: 135.8±0.4 cm3
#H bond acceptors: 9
#H bond donors: 4
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 1
ACD/LogP: 2.61
ACD/LogD (pH 5.5): 2.57
ACD/BCF (pH 5.5): 52.91
ACD/KOC (pH 5.5): 596.07
ACD/LogD (pH 7.4): 2.57
ACD/BCF (pH 7.4): 52.90
ACD/KOC (pH 7.4): 596.07
Polar Surface Area: 135 Å2
Polarizability: 53.8±0.5 10-24cm3
Surface Tension: 49.6±5.0 dyne/cm
Molar Volume: 436.5±5.0 cm3

Click to predict properties on the Chemicalize site


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