ChemSpider 2D Image | cathasterone | C28H48O3

cathasterone

  • Molecular FormulaC28H48O3
  • Average mass432.679 Da
  • Monoisotopic mass432.360352 Da
  • ChemSpider ID21864875

  • defined stereocentres - 11 of 11 defined stereocentres

More details:

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

(3β,5α,22S,24R)-3,22-Dihydroxyergostan-6-on [German] [ACD/IUPAC Name]
(3β,5α,22S,24R)-3,22-Dihydroxyergostan-6-one [ACD/IUPAC Name]
(3β,5α,22S,24R)-3,22-Dihydroxyergostan-6-one [French] [ACD/IUPAC Name]
cathasterone
Ergostan-6-one, 3,22-dihydroxy-, (3β,5α,22S,24R)- [ACD/Index Name]
(22S)-3β,22-dihydroxy-5α-campestan-6-one
168146-23-4 [RN]
6-oxo-campestan-3β,22R-diol
6-oxo-campestan-3β,22S-diol
7416517 [Beilstein]
More...
  • Miscellaneous

    • Compound Source:

      Aegilops tauschii PlantCyc CPD-714
      Amaranthus hypochondriacus PlantCyc CPD-714
      Amborella trichopoda PlantCyc CPD-714
      Anacardium occidentale PlantCyc CPD-714
      Ananas comosus PlantCyc CPD-714
      Aquilegia coerulea PlantCyc CPD-714
      Arabidopsis halleri PlantCyc CPD-714
      Arabidopsis lyrata PlantCyc CPD-714
      Arabidopsis thaliana col PlantCyc CPD-714
      Beta vulgaris subsp. vulgaris PlantCyc CPD-714
      Boechera stricta PlantCyc CPD-714
      Brachypodium distachyon PlantCyc CPD-714
      Brassica napus PlantCyc CPD-714
      Brassica oleracea var. capitata PlantCyc CPD-714
      Brassica oleracea var. oleracea PlantCyc CPD-714
      Brassica rapa FPsc PlantCyc CPD-714
      Brassica rapa subsp. pekinensis PlantCyc CPD-714
      brassinosteroid biosynthesis I PlantCyc CPD-714
      Calotropis gigantea PlantCyc CPD-714
      Camptotheca acuminata PlantCyc CPD-714
      Cannabis sativa PlantCyc CPD-714
      Capsella grandiflora PlantCyc CPD-714
      Capsella rubella PlantCyc CPD-714
      Capsicum annuum PlantCyc CPD-714
      Carica papaya PlantCyc CPD-714
      Catharanthus roseus PlantCyc CPD-714
      Chenopodium quinoa PlantCyc CPD-714
      Cicer arietinum PlantCyc CPD-714
      Citrus clementina PlantCyc CPD-714
      Citrus sinensis PlantCyc CPD-714
      Corchorus capsularis PlantCyc CPD-714
      Cucumis sativus PlantCyc CPD-714
      Daucus carota subsp. sativus PlantCyc CPD-714
      Dianthus caryophyllus PlantCyc CPD-714
      Dioscorea rotundata PlantCyc CPD-714
      Eucalyptus grandis PlantCyc CPD-714
      Eutrema salsugineum PlantCyc CPD-714
      Fragaria vesca subsp. vesca PlantCyc CPD-714
      Glycine max PlantCyc CPD-714
      Gossypium raimondii PlantCyc CPD-714
      Helianthus annuus PlantCyc CPD-714
      Hordeum vulgare subsp. vulgare PlantCyc CPD-714
      Humulus lupulus var. lupulus PlantCyc CPD-714
      Kalanchoe fedtschenkoi PlantCyc CPD-714
      Kalanchoe laxiflora PlantCyc CPD-714
      Leersia perrieri PlantCyc CPD-714
      Linum usitatissimum PlantCyc CPD-714
      Lotus japonicus PlantCyc CPD-714
      Malus domestica PlantCyc CPD-714
      Manihot esculenta PlantCyc CPD-714
      Medicago truncatula PlantCyc CPD-714
      Mimulus guttatus PlantCyc CPD-714
      Miscanthus sinensis PlantCyc CPD-714
      Musa acuminata PlantCyc CPD-714
      Nicotiana tabacum PlantCyc CPD-714
      Olea europaea var. sylvestris PlantCyc CPD-714
      Oropetium thomaeum PlantCyc CPD-714
      Oryza brachyantha PlantCyc CPD-714
      Oryza glaberrima PlantCyc CPD-714
      Oryza punctata PlantCyc CPD-714
      Oryza rufipogon PlantCyc CPD-714
      Oryza sativa Japonica Group PlantCyc CPD-714
      Panicum hallii PlantCyc CPD-714
      Panicum virgatum PlantCyc CPD-714
      Petunia axillaris PlantCyc CPD-714
      Phaseolus vulgaris PlantCyc CPD-714
      Populus trichocarpa PlantCyc CPD-714
      Prunus persica PlantCyc CPD-714
      Ricinus communis PlantCyc CPD-714
      Rosa chinensis PlantCyc CPD-714
      Rosa multiflora PlantCyc CPD-714
      Salvia miltiorrhiza PlantCyc CPD-714
      Setaria italica PlantCyc CPD-714
      Setaria viridis PlantCyc CPD-714
      Solanum lycopersicum PlantCyc CPD-714
      Solanum melongena PlantCyc CPD-714
      Solanum pennellii PlantCyc CPD-714
      Solanum tuberosum PlantCyc CPD-714
      Sorghum bicolor PlantCyc CPD-714
      Spinacia oleracea PlantCyc CPD-714
      Spirodela polyrhiza PlantCyc CPD-714
      Thellungiella parvula PlantCyc CPD-714
      Theobroma cacao PlantCyc CPD-714
      Trifolium pratense PlantCyc CPD-714
      Triticum aestivum PlantCyc CPD-714
      Triticum urartu PlantCyc CPD-714
      Vitis vinifera PlantCyc CPD-714
      Zea mays subsp. mays PlantCyc CPD-714
      Zostera marina PlantCyc CPD-714

    • Bio Activity:

      6-oxocampestanol + NADPH + H+ + oxygen -> cathasterone + NADP+ + H2O PlantCyc CPD-714
      cathasterone + a reduced electron acceptor + oxygen -> teasterone + an oxidized electron acceptor + H2O PlantCyc CPD-714

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

Density: 1.0±0.1 g/cm3
Boiling Point: 541.4±25.0 °C at 760 mmHg
Vapour Pressure: 0.0±3.3 mmHg at 25°C
Enthalpy of Vaporization: 94.2±6.0 kJ/mol
Flash Point: 295.3±19.7 °C
Index of Refraction: 1.518
Molar Refractivity: 126.6±0.3 cm3
#H bond acceptors: 3
#H bond donors: 2
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 1
ACD/LogP: 6.13
ACD/LogD (pH 5.5): 5.18
ACD/BCF (pH 5.5): 5104.93
ACD/KOC (pH 5.5): 15695.38
ACD/LogD (pH 7.4): 5.18
ACD/BCF (pH 7.4): 5104.93
ACD/KOC (pH 7.4): 15695.38
Polar Surface Area: 58 Å2
Polarizability: 50.2±0.5 10-24cm3
Surface Tension: 39.3±3.0 dyne/cm
Molar Volume: 417.4±3.0 cm3

Click to predict properties on the Chemicalize site


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