Sprengelianine, (+/-)-

Base Information

• Chemical Name: Sprengelianine, (+/-)-
• CAS No.: 36706-20-4
• Molecular Formula: C₁₉H₂₀O₅
• Molecular Weight: 328.365
• UNII: W9DD92ZQ94
• Wikidata: Q27292499
• Mol file: 36706-20-4.mol

Synonyms:Sprengelianin;Sprengelianine;Sprengelianine, (+/-)-;W9DD92ZQ94;UNII-W9DD92ZQ94;2-Butenoic acid, 2-methyl-, 1-(2,3-dihydro-7-oxo-7H-furo(3,2-g)(1)benzopyran-2-yl)-1-methylethyl ester, (2E)-;2-Butenoic acid, 2-methyl-, 1-(2,3-dihydro-7-oxo-7H-furo(3,2-g)(1)benzopyran-2-yl)-1-methylethyl ester, (E)-(+/-)-;36706-20-4;(+/-)-sprengelianine;Compound NP-002719;MEGxp0_000941;ACon1_001235;AKOS040739940;BRD-A37610653-001-01-8;Q27292499

Chemical Property of Sprengelianine, (+/-)-

Chemical Property:

• PSA: 65.74000
• LogP: 3.38450
• XLogP3: 3.7
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 5
• Rotatable Bond Count: 4
• Exact Mass: 328.13107373
• Heavy Atom Count: 24
• Complexity: 589

Purity/Quality:

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC=C(C)C(=O)OC(C)(C)C1CC2=C(O1)C=C3C(=C2)C=CC(=O)O3
• Isomeric SMILES: C/C=C(\C)/C(=O)OC(C)(C)C1CC2=C(O1)C=C3C(=C2)C=CC(=O)O3