ChemSpider 2D Image | Methoserpidine | C33H40N2O9

Methoserpidine

  • Molecular FormulaC33H40N2O9
  • Average mass608.679 Da
  • Monoisotopic mass608.273376 Da
  • ChemSpider ID64824

  • defined stereocentres - 6 of 6 defined stereocentres

More details:

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

(3b,16b,17a,18b,20a)-10,17-Dimethoxy-18-((3,4,5-trimethoxybenzoyl)oxy)yohimban-16-carboxylic acid methyl ester
(3β,16β,17α,18β,20α)-10,17-Diméthoxy-18-[(3,4,5-triméthoxybenzoyl)oxy]yohimban-16-carboxylate de méthyle [French] [ACD/IUPAC Name]
10-MD
10-Methoxydeserpidine
212-733-5 [EINECS]
3β,20α-Yohimban-16β-carboxylic acid, 18β-hydroxy-10,17α-dimethoxy-, methyl ester, 3,4,5-trimethoxybenzoate (ester) (8CI)
865-04-3 [RN]
8F8C1JQH53
Deaserpyl
Decaserpin
More...

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

1081 [DBID]
NSC 169423 [DBID]
R 694 [DBID]

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

Density: 1.3±0.1 g/cm3
Boiling Point: 700.1±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.2 mmHg at 25°C
Enthalpy of Vaporization: 102.5±3.0 kJ/mol
Flash Point: 377.2±32.9 °C
Index of Refraction: 1.620
Molar Refractivity: 160.9±0.4 cm3
#H bond acceptors: 11
#H bond donors: 1
#Freely Rotating Bonds: 10
#Rule of 5 Violations: 2
ACD/LogP: 4.11
ACD/LogD (pH 5.5): 2.45
ACD/BCF (pH 5.5): 16.40
ACD/KOC (pH 5.5): 82.85
ACD/LogD (pH 7.4): 3.95
ACD/BCF (pH 7.4): 523.63
ACD/KOC (pH 7.4): 2644.83
Polar Surface Area: 118 Å2
Polarizability: 63.8±0.5 10-24cm3
Surface Tension: 59.9±5.0 dyne/cm
Molar Volume: 458.2±5.0 cm3

Click to predict properties on the Chemicalize site


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