Found 10 results

Search term: MF = 'C_{33}H_{37}NO_{12}'
ChemSpider 2D Image | 8-Acetyl-1,6,8,11-tetrahydroxy-10-{[(5Z)-2-(2-hydroxypropyl)-4,10-dimethyl-4,6a,7,8,10,10a-hexahydropyrano[3,4-d][1,3,6]dioxazocin-8-yl]oxy}-7,8,9,10-tetrahydro-5,12-tetracenedione | C33H37NO12

8-Acetyl-1,6,8,11-tetrahydroxy-10-{[(5Z)-2-(2-hydroxypropyl)-4,10-dimethyl-4,6a,7,8,10,10a-hexahydropyrano[3,4-d][1,3,6]dioxazocin-8-yl]oxy}-7,8,9,10-tetrahydro-5,12-tetracenedione

  • Molecular FormulaC33H37NO12
  • Average mass639.646 Da
  • Monoisotopic mass639.231567 Da
  • ChemSpider ID140113

  • Double-bond stereo - Double-bond stereo

More details:

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

5,12-Naphthacenedione, 8-acetyl-10-[[(5Z)-4,6a,7,8,10,10a-hexahydro-2-(2-hydroxypropyl)-4,10-dimethylpyrano[3,4-d]-1,3,6-dioxazocin-8-yl]oxy]-7,8,9,10-tetrahydro-1,6,8,11-tetrahydroxy- [ACD/Index Name]
8-Acetyl-1,6,8,11-tetrahydroxy-10-{[(5Z)-2-(2-hydroxypropyl)-4,10-dimethyl-4,6a,7,8,10,10a-hexahydropyrano[3,4-d][1,3,6]dioxazocin-8-yl]oxy}-7,8,9,10-tetrahydro-5,12-tetracendion [German] [ACD/IUPAC Name]
8-Acetyl-1,6,8,11-tetrahydroxy-10-{[(5Z)-2-(2-hydroxypropyl)-4,10-dimethyl-4,6a,7,8,10,10a-hexahydropyrano[3,4-d][1,3,6]dioxazocin-8-yl]oxy}-7,8,9,10-tetrahydro-5,12-tetracenedione [ACD/IUPAC Name]
8-Acétyl-1,6,8,11-tétrahydroxy-10-{[(5Z)-2-(2-hydroxypropyl)-4,10-diméthyl-4,6a,7,8,10,10a-hexahydropyrano[3,4-d][1,3,6]dioxazocin-8-yl]oxy}-7,8,9,10-tétrahydro-5,12-tétracènedione [French] [ACD/IUPAC Name]
108147-17-7 [RN]
1182-06-5 [RN]
5,12-Naphthacenedione, 8-acetyl-10-((4,6a,7,8,10,10a-hexahydro-2-(2-hydroxypropyl)-4,10-dimethylpyrano(3,4-d)-1,3,6-dioxazocin-8-yl)oxy)-7,8,9,10-tetrahydro-1,6,8,``-tetrahydroxy-
8-ACETYL-1,6,8,11-TETRAHYDROXY-10-{[(5Z)-2-(2-HYDROXYPROPYL)-4,10-DIMETHYL-4,6A,7,8,10,10A-HEXAHYDROPYRANO[3,4-D][1,3,6]DIOXAZOCIN-8-YL]OXY}-7,8,9,10-TETRAHYDROTETRACENE-5,12-DIONE
Antibiotic SN-07 chromophore
Barminomycin I
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Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module, version: 14.00

Density: 1.6±0.1 g/cm3
Boiling Point: 829.7±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±3.2 mmHg at 25°C
Enthalpy of Vaporization: 126.4±3.0 kJ/mol
Flash Point: 455.6±34.3 °C
Index of Refraction: 1.695
Molar Refractivity: 154.6±0.5 cm3
#H bond acceptors: 13
#H bond donors: 5
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 3
ACD/LogP: 4.09
ACD/LogD (pH 5.5): 3.46
ACD/BCF (pH 5.5): 239.62
ACD/KOC (pH 5.5): 1668.21
ACD/LogD (pH 7.4): 2.13
ACD/BCF (pH 7.4): 11.26
ACD/KOC (pH 7.4): 78.42
Polar Surface Area: 202 Å2
Polarizability: 61.3±0.5 10-24cm3
Surface Tension: 61.4±7.0 dyne/cm
Molar Volume: 402.3±7.0 cm3

Click to predict properties on the Chemicalize site


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