Found 120 results

Search term: C26H40O8 (Found by molecular formula)
ChemSpider 2D Image | (3R,3aS,5S,5aS,7aR,10S,10aR,12aR,12bS,13aS,13bS,13cR)-8-Isopropyl-5-methoxy-10a,12a-dimethyl-5a,6,7,7a,9,10,10a,11,12,12a,12b,13c-dodecahydro-2H,5H-1,4,13-trioxaindeno[4',5':6,7]cyclohepta[1,2,3-bc]ac enaphthylene-3,3a,10,13b(3H,13aH)-tetrol | C26H40O8

(3R,3aS,5S,5aS,7aR,10S,10aR,12aR,12bS,13aS,13bS,13cR)-8-Isopropyl-5-methoxy-10a,12a-dimethyl-5a,6,7,7a,9,10,10a,11,12,12a,12b,13c-dodecahydro-2H,5H-1,4,13-trioxaindeno[4',5':6,7]cyclohepta[1,2,3-bc]ac enaphthylene-3,3a,10,13b(3H,13aH)-tetrol

  • Molecular FormulaC26H40O8
  • Average mass480.591 Da
  • Monoisotopic mass480.272308 Da
  • ChemSpider ID58838873

  • defined stereocentres - 12 of 12 defined stereocentres

More details:

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

(3R,3aS,5S,5aS,7aR,10S,10aR,12aR,12bS,13aS,13bS,13cR)-8-Isopropyl-5-methoxy-10a,12a-dimethyl-5a,6,7,7a,9,10,10a,11,12,12a,12b,13c-dodecahydro-2H,5H-1,4,13-trioxaindeno[4',5':6,7]cyclohepta[1,2,3-bc]ac enaphthylen-3,3a,10,13b(3H,13aH)-tetrol [German] [ACD/IUPAC Name]
(3R,3aS,5S,5aS,7aR,10S,10aR,12aR,12bS,13aS,13bS,13cR)-8-Isopropyl-5-methoxy-10a,12a-dimethyl-5a,6,7,7a,9,10,10a,11,12,12a,12b,13c-dodecahydro-2H,5H-1,4,13-trioxaindeno[4',5':6,7]cyclohepta[1,2,3-bc]ac enaphthylene-3,3a,10,13b(3H,13aH)-tetrol [ACD/IUPAC Name]
(3R,3aS,5S,5aS,7aR,10S,10aR,12aR,12bS,13aS,13bS,13cR)-8-Isopropyl-5-méthoxy-10a,12a-diméthyl-5a,6,7,7a,9,10,10a,11,12,12a,12b,13c-dodécahydro-2H,5H-1,4,13-trioxaindéno[4',5':6,7]cyclohepta[1,2,3-bc]ac énaphtylène-3,3a,10,13b(3H,13aH)-tétrol [French] [ACD/IUPAC Name]
2H,5H-1,4,13-Trioxaindeno[4',5':6,7]cyclohept[1,2,3-bc]acenaphthylene-3,3a,10,13b(3H,13aH)-tetrol, 5a,6,7,7a,9,10,10a,11,12,12a,12b,13c-dodecahydro-5-methoxy-10a,12a-dimethyl-8-(1-methylethyl)-, (3R,3 aS,5S,5aS,7aR,10S,10aR,12aR,12bS,13aS,13bS,13cR)- [ACD/Index Name]
Striatoid A

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

Density: 1.4±0.1 g/cm3
Boiling Point: 633.0±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±4.2 mmHg at 25°C
Enthalpy of Vaporization: 107.2±6.0 kJ/mol
Flash Point: 336.6±31.5 °C
Index of Refraction: 1.606
Molar Refractivity: 122.6±0.4 cm3
#H bond acceptors: 8
#H bond donors: 4
#Freely Rotating Bonds: 2
#Rule of 5 Violations: 1
ACD/LogP: 6.67
ACD/LogD (pH 5.5): 5.03
ACD/BCF (pH 5.5): 3918.11
ACD/KOC (pH 5.5): 12987.27
ACD/LogD (pH 7.4): 5.03
ACD/BCF (pH 7.4): 3917.28
ACD/KOC (pH 7.4): 12984.53
Polar Surface Area: 118 Å2
Polarizability: 48.6±0.5 10-24cm3
Surface Tension: 60.5±5.0 dyne/cm
Molar Volume: 355.4±5.0 cm3

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