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Technology Process of Provincialin

Provincialin

Base Information
  • Chemical Name:Provincialin
  • CAS No.:40328-96-9
  • Molecular Formula:C27H34O10
  • Molecular Weight:518.5529
  • Hs Code.:
  • DSSTox Substance ID:DTXSID001098155
  • Nikkaji Number:J18.413F
  • Wikidata:Q27108106
  • Mol file:40328-96-9.mol
Provincialin

Synonyms:PROVINCIALIN;40328-96-9;C09533;CHEBI:8599;DTXSID001098155;[(3aR,4R,6E,9S,10Z,11aR)-9-acetyloxy-6,10-dimethyl-3-methylidene-2-oxo-3a,4,5,8,9,11a-hexahydrocyclodeca[b]furan-4-yl] (E)-4-hydroxy-2-[[(E)-2-(hydroxymethyl)but-2-enoyl]oxymethyl]but-2-enoate;Q27108106;2-Butenoic acid, 4-hydroxy-2-[[[(2E)-2-(hydroxymethyl)-1-oxo-2-buten-1-yl]oxy]methyl]-, (3aR,4R,6E,9S,10Z,11aR)-9-(acetyloxy)-2,3,3a,4,5,8,9,11a-octahydro-6,10-dimethyl-3-methylene-2-oxocyclodeca[b]furan-4-yl ester, (2E)-

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Chemical Property of Provincialin
Chemical Property:
  • Vapor Pressure:2.84E-22mmHg at 25°C 
  • Boiling Point:693.9°C at 760 mmHg 
  • Flash Point:225.7°C 
  • Density:1.26g/cm3 
  • XLogP3:1.1
  • Hydrogen Bond Donor Count:2
  • Hydrogen Bond Acceptor Count:10
  • Rotatable Bond Count:11
  • Exact Mass:518.21519728
  • Heavy Atom Count:37
  • Complexity:1050
Purity/Quality:
Safty Information:
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MSDS Files:

SDS file from LookChem

Useful:
  • Canonical SMILES:CC=C(CO)C(=O)OCC(=CCO)C(=O)OC1CC(=CCC(C(=CC2C1C(=C)C(=O)O2)C)OC(=O)C)C
  • Isomeric SMILES:C/C=C(\CO)/C(=O)OC/C(=C\CO)/C(=O)O[C@@H]1C/C(=C/C[C@@H](/C(=C\[C@@H]2[C@@H]1C(=C)C(=O)O2)/C)OC(=O)C)/C
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