ChemSpider 2D Image | Naphthomycin D | C40H47NO10

Naphthomycin D

  • Molecular FormulaC40H47NO10
  • Average mass701.802 Da
  • Monoisotopic mass701.320007 Da
  • ChemSpider ID10389022

  • Double-bond stereo - Double-bond stereo

    defined stereocentres - 6 of 6 defined stereocentres

More details:

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

(7E,9S,10S,11S,12E,14S,16E,20S,21S,22E,24Z,26Z)-4,10,14,20,31-Pentahydroxy-3,7,9,11,17,21,27-heptamethyl-29-azatricyclo[28.3.1.05,33]tetratriaconta-1(33),2,4,7,12,16,22,24,26,30-decaen-6,18,28,32,34 -penton [German] [ACD/IUPAC Name]
(7E,9S,10S,11S,12E,14S,16E,20S,21S,22E,24Z,26Z)-4,10,14,20,31-Pentahydroxy-3,7,9,11,17,21,27-heptamethyl-29-azatricyclo[28.3.1.05,33]tetratriaconta-1(33),2,4,7,12,16,22,24,26,30-decaene-6,18,28,32,3 4-pentone [ACD/IUPAC Name]
(7E,9S,10S,11S,12E,14S,16E,20S,21S,22E,24Z,26Z)-4,10,14,20,31-Pentahydroxy-3,7,9,11,17,21,27-heptaméthyl-29-azatricyclo[28.3.1.05,33]tétratriaconta-1(33),2,4,7,12,16,22,24,26,30-décaène-6,18,28,32,3 4-pentone [French] [ACD/IUPAC Name]
3,31-Methano-1H-4-benzazacyclononacosine-1,5,15,27,32(4H,12H,18H)-pentone, 13,14,19,22,23,24-hexahydro-2,13,19,23,28-pentahydroxy-6,12,16,22,24,26,29-heptamethyl-, (6Z,8Z,10E,12S,13S,16E,19S,20E,22S,2 3S,24S,25E)- [ACD/Index Name]
Naphthomycin D

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

Density: 1.3±0.1 g/cm3
Boiling Point: 988.7±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.3 mmHg at 25°C
Enthalpy of Vaporization: 151.0±3.0 kJ/mol
Flash Point: 551.8±34.3 °C
Index of Refraction: 1.628
Molar Refractivity: 190.1±0.4 cm3
#H bond acceptors: 11
#H bond donors: 6
#Freely Rotating Bonds: 0
#Rule of 5 Violations: 3
ACD/LogP: 4.16
ACD/LogD (pH 5.5): 1.75
ACD/BCF (pH 5.5): 4.72
ACD/KOC (pH 5.5): 33.28
ACD/LogD (pH 7.4): -0.88
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 199 Å2
Polarizability: 75.4±0.5 10-24cm3
Surface Tension: 65.0±5.0 dyne/cm
Molar Volume: 535.8±5.0 cm3

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