ChemSpider 2D Image | Methyl 15-[(13Z)-13-ethylidene-18-(methoxycarbonyl)-4-oxo-8,15-diazapentacyclo[10.5.1.0~1,9~.0~2,7~.0~9,15~]octadeca-2,5,7-trien-5-yl]-16-methoxy-1-methyl-2,3-didehydroaspidospermidine-3-carboxylate | C43H50N4O6

Methyl 15-[(13Z)-13-ethylidene-18-(methoxycarbonyl)-4-oxo-8,15-diazapentacyclo[10.5.1.01,9.02,7.09,15]octadeca-2,5,7-trien-5-yl]-16-methoxy-1-methyl-2,3-didehydroaspidospermidine-3-carboxylate

  • Molecular FormulaC43H50N4O6
  • Average mass718.880 Da
  • Monoisotopic mass718.373047 Da
  • ChemSpider ID4946202

  • Double-bond stereo - Double-bond stereo

More details:

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

15-[(13Z)-13-Éthylidène-18-(méthoxycarbonyl)-4-oxo-8,15-diazapentacyclo[10.5.1.01,9.02,7.09,15]octadéca-2,5,7-trién-5-yl]-16-méthoxy-1-méthyl-2,3-didéhydroaspidospermidine-3-carboxylate de méthy le [French] [ACD/IUPAC Name]
Aspidospermidine-3-carboxylic acid, 2,3-didehydro-15-[(4Z)-4-ethylidene-2,3,4,5,7,8-hexahydro-14-(methoxycarbonyl)-10-oxo-10H-3,8a-methano-1H-azepino[1',2':1,2]pyrrolo[2,3-b]indol-11-yl]-16-methoxy-1- methyl-, methyl ester [ACD/Index Name]
Methyl 15-[(13Z)-13-ethylidene-18-(methoxycarbonyl)-4-oxo-8,15-diazapentacyclo[10.5.1.01,9.02,7.09,15]octadeca-2,5,7-trien-5-yl]-16-methoxy-1-methyl-2,3-didehydroaspidospermidine-3-carboxylate [ACD/IUPAC Name]
Methyl-15-[(13Z)-13-ethyliden-18-(methoxycarbonyl)-4-oxo-8,15-diazapentacyclo[10.5.1.01,9.02,7.09,15]octadeca-2,5,7-trien-5-yl]-16-methoxy-1-methyl-2,3-didehydroaspidospermidin-3-carboxylat [German] [ACD/IUPAC Name]
107290-03-9 [RN]
Vincarubine

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

Density: 1.4±0.1 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.717
Molar Refractivity: 197.9±0.5 cm3
#H bond acceptors: 10
#H bond donors: 0
#Freely Rotating Bonds: 7
#Rule of 5 Violations: 3
ACD/LogP: 7.29
ACD/LogD (pH 5.5): 3.26
ACD/BCF (pH 5.5): 26.55
ACD/KOC (pH 5.5): 38.25
ACD/LogD (pH 7.4): 4.97
ACD/BCF (pH 7.4): 1340.17
ACD/KOC (pH 7.4): 1930.53
Polar Surface Area: 101 Å2
Polarizability: 78.5±0.5 10-24cm3
Surface Tension: 56.5±7.0 dyne/cm
Molar Volume: 502.4±7.0 cm3

Click to predict properties on the Chemicalize site


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