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Thevetin A

Base Information
  • Chemical Name:Thevetin A
  • CAS No.:37933-66-7
  • Molecular Formula:C42H64O19
  • Molecular Weight:872.9462
  • Hs Code.:
  • European Community (EC) Number:253-722-5
  • UNII:788WS2ZR7A
  • DSSTox Substance ID:DTXSID001043293
  • Nikkaji Number:J3.340.907I
  • Wikidata:Q27103924
  • Metabolomics Workbench ID:35233
  • Mol file:37933-66-7.mol
Thevetin A

Synonyms:Thevetin A;37933-66-7;Cannogenin 3-O-gentiobiosylthevetoside;UNII-788WS2ZR7A;788WS2ZR7A;EINECS 253-722-5;Cannogenin + L-thevetose + 2-glucose;Cannogenin + L-thevetose + 2-glucose [German];3beta-(beta-D-glucopyranosyl-(1-6)-beta-D-glucopyranosyl-(1-4)-6-deoxy-3-O-methyl-alpha-L-glucopyranosyloxy)-14-hydroxy-19-oxo-5beta-card-20(22)-enolide;Card-20(22)-enolide, 3-[(O-beta-D-glucopyranosyl-(1-->6)-O-beta-D-glucopyranosyl-(1-->4)-6-deoxy-3-O-methyl-alpha-L-glucopyranosyl)oxy]-14-hydroxy-19-oxo-, (3beta,5beta)-;THEVETIN A [MI];SCHEMBL867986;CHEBI:28841;DTXSID001043293;(3beta,5beta)-3-((O-beta-D-glucopyranosyl-(1.6)-O-D-glucopyranosyl-(1.4)-6-deoxy-3-O-methyl-alpha-L-glucopyranosyl)oxy)-14-hydroxy-19-oxocard-20(22)-enolide;5-beta-Card-20(22)-enolide, 3-beta-((O-beta-D-glucopyranosyl-(1-6)-O-D-glucopyranosyl-(1-4)-6-deoxy-3-O-methyl-alpha-L-glucopyranosyl)oxy)-14-hydroxy-19-oxo-;LMST01120019;C08882;E88983;Q27103924;(3beta,5beta)-3-[(O-beta-D-glucopyranosyl-(1.fwdarw.6)-O-D-glucopyranosyl-(1.fwdarw.4)-6-deoxy-3-O-methyl-alpha-L-glucopyranosyl)oxy]-14-hydroxy-19-oxocard-20(22)-enolide;14-Hydroxy-19-oxo-3beta-[4-O-[6-O-(beta-D-glucopyranosyl)-beta-D-glucopyranosyl]-3-O-methyl-6-deoxy-alpha-L-glucopyranosyloxy]-5beta-carda-20(22)-enolide;3beta-(beta-D-glucopyranosyl-(1->6)-beta-D-glucopyranosyl-(1->4)-6-deoxy-3-O-methyl-alpha-L-glucopyranosyloxy)-14-hydroxy-19-oxo-5beta-card-20(22)-enolide;CARD-20(22)-ENOLIDE, 3-((O-.BETA.-D-GLUCOPYRANOSYL-(1->6)-O-.BETA.-D-GLUCOPYRANOSYL-(1->4)-6-DEOXY-3-O-METHYL-.ALPHA.-L-GLUCOPYRANOSYL)OXY)-14-HYDROXY-19-OXO-, (3.BETA.,5.BETA.)-;Card-20(22)-enolide, 3-[(O-.beta.-D-glucopyranosyl-(1.fwdarw.6)-O-D-glucopyranosyl-(1.fwdarw.4)-6-deoxy-3-O-methyl-.alpha.-L-glucopyranosyl)oxy]-14-hydroxy-19-oxo-, (3.beta.,5.beta.)-

Suppliers and Price of Thevetin A
Supply Marketing:
Business phase:
The product has achieved commercial mass production*data from LookChem market partment
Manufacturers and distributors:
  • Manufacture/Brand
  • Chemicals and raw materials
  • Packaging
  • price
Total 12 raw suppliers
Chemical Property of Thevetin A
Chemical Property:
  • Boiling Point:1035.6°Cat760mmHg 
  • Flash Point:306.7°C 
  • Density:1.49g/cm3 
  • XLogP3:-3
  • Hydrogen Bond Donor Count:9
  • Hydrogen Bond Acceptor Count:19
  • Rotatable Bond Count:11
  • Exact Mass:872.40417981
  • Heavy Atom Count:61
  • Complexity:1620
Purity/Quality:

≥98% *data from raw suppliers

Safty Information:
  • Pictogram(s):  
  • Hazard Codes: 
MSDS Files:

SDS file from LookChem

Useful:
  • Canonical SMILES:CC1C(C(C(C(O1)OC2CCC3(C(C2)CCC4C3CCC5(C4(CCC5C6=CC(=O)OC6)O)C)C=O)O)OC)OC7C(C(C(C(O7)COC8C(C(C(C(O8)CO)O)O)O)O)O)O
  • Isomeric SMILES:C[C@H]1[C@@H]([C@H]([C@@H]([C@@H](O1)O[C@H]2CC[C@]3([C@@H](C2)CC[C@@H]4[C@@H]3CC[C@]5([C@@]4(CC[C@@H]5C6=CC(=O)OC6)O)C)C=O)O)OC)O[C@H]7[C@@H]([C@H]([C@@H]([C@H](O7)CO[C@H]8[C@@H]([C@H]([C@@H]([C@H](O8)CO)O)O)O)O)O)O
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