ChemSpider 2D Image | (4Z,6Z,8E,10E)-3-Hydroxy-N-[(2E,4E)-6-hydroxy-9-(8-hydroxy-1,5,7-trimethyl-3,6-dioxo-2-oxa-5-azaspiro[3.4]oct-8-yl)-9-methoxy-7-methyl-2,4-nonadien-1-yl]-2,2,4,10-tetramethyl-11-nitro-4,6,8,10-dodecat etraenamide | C36H53N3O10

(4Z,6Z,8E,10E)-3-Hydroxy-N-[(2E,4E)-6-hydroxy-9-(8-hydroxy-1,5,7-trimethyl-3,6-dioxo-2-oxa-5-azaspiro[3.4]oct-8-yl)-9-methoxy-7-methyl-2,4-nonadien-1-yl]-2,2,4,10-tetramethyl-11-nitro-4,6,8,10-dodecat etraenamide

  • Molecular FormulaC36H53N3O10
  • Average mass687.820 Da
  • Monoisotopic mass687.373108 Da
  • ChemSpider ID9356616

  • Double-bond stereo - Double-bond stereo

More details:

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(4Z,6Z,8E,10E)-3-Hydroxy-N-[(2E,4E)-6-hydroxy-9-(8-hydroxy-1,5,7-trimethyl-3,6-dioxo-2-oxa-5-azaspiro[3.4]oct-8-yl)-9-methoxy-7-methyl-2,4-nonadien-1-yl]-2,2,4,10-tetramethyl-11-nitro-4,6,8,10-dodecat etraenamid [German] [ACD/IUPAC Name]
(4Z,6Z,8E,10E)-3-Hydroxy-N-[(2E,4E)-6-hydroxy-9-(8-hydroxy-1,5,7-trimethyl-3,6-dioxo-2-oxa-5-azaspiro[3.4]oct-8-yl)-9-methoxy-7-methyl-2,4-nonadien-1-yl]-2,2,4,10-tetramethyl-11-nitro-4,6,8,10-dodecat etraenamide [ACD/IUPAC Name]
(4Z,6Z,8E,10E)-3-Hydroxy-N-[(2E,4E)-6-hydroxy-9-(8-hydroxy-1,5,7-triméthyl-3,6-dioxo-2-oxa-5-azaspiro[3.4]oct-8-yl)-9-méthoxy-7-méthyl-2,4-nonadién-1-yl]-2,2,4,10-tétraméthyl-11-nitro-4,6,8,10-dodécat étraénamide [French] [ACD/IUPAC Name]
4,6,8,10-Dodecatetraenamide, 3-hydroxy-N-[(2E,4E)-6-hydroxy-9-(8-hydroxy-1,5,7-trimethyl-3,6-dioxo-2-oxa-5-azaspiro[3.4]oct-8-yl)-9-methoxy-7-methyl-2,4-nonadien-1-yl]-2,2,4,10-tetramethyl-11-nitro-, (4Z,6Z,8E,10E)- [ACD/Index Name]
4,6,8,10-dodecatetraenimidic acid, 3-hydroxy-N-[(2E,4E)-6-hydroxy-9-(8-hydroxy-1,5,7-trimethyl-3,6-dioxo-2-oxa-5-azaspiro[3.4]oct-8-yl)-9-methoxy-7-methyl-2,4-nonadien-1-yl]-2,2,4,10-tetramethyl-11-nitro-, (1Z,4Z,6Z,8E,10E)-
lajollamycin

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

Density: 1.2±0.1 g/cm3
Boiling Point: 908.5±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.6 mmHg at 25°C
Enthalpy of Vaporization: 150.0±6.0 kJ/mol
Flash Point: 503.3±34.3 °C
Index of Refraction: 1.574
Molar Refractivity: 185.3±0.4 cm3
#H bond acceptors: 13
#H bond donors: 4
#Freely Rotating Bonds: 16
#Rule of 5 Violations: 2
ACD/LogP: 2.14
ACD/LogD (pH 5.5): 2.65
ACD/BCF (pH 5.5): 60.91
ACD/KOC (pH 5.5): 659.32
ACD/LogD (pH 7.4): 2.65
ACD/BCF (pH 7.4): 60.91
ACD/KOC (pH 7.4): 659.28
Polar Surface Area: 191 Å2
Polarizability: 73.5±0.5 10-24cm3
Surface Tension: 54.5±5.0 dyne/cm
Molar Volume: 561.3±5.0 cm3

Click to predict properties on the Chemicalize site


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