5,6,7-Trihydroxy-1-methyl-6-propan-2-yl-3,9,15-trioxahexacyclo[10.7.0.02,4.02,8.08,10.013,17]nonadec-13(17)-en-16-one

Base Information

• Chemical Name: 5,6,7-Trihydroxy-1-methyl-6-propan-2-yl-3,9,15-trioxahexacyclo[10.7.0.02,4.02,8.08,10.013,17]nonadec-13(17)-en-16-one
• CAS No.: 147852-78-6
• Molecular Formula: C20H26 O7
• Molecular Weight: 378.42
• DSSTox Substance ID: DTXSID00694524
• Wikidata: Q82623662
• Mol file: 147852-78-6.mol

Synonyms:147852-78-6;DTXSID00694524;9,10,11-Trihydroxy-1b-methyl-10-(propan-2-yl)-1b,3,6,6b,7,7a,9,10,11,11a-decahydrobisoxireno[8a,9:4b,5]phenanthro[1,2-c]furan-4(2H)-one

Chemical Property of 5,6,7-Trihydroxy-1-methyl-6-propan-2-yl-3,9,15-trioxahexacyclo[10.7.0.02,4.02,8.08,10.013,17]nonadec-13(17)-en-16-one

Chemical Property:

• Vapor Pressure: 2.05E-18mmHg at 25°C
• Boiling Point: 628.1°Cat760mmHg
• Flash Point: 227.2°C
• PSA: 112.05000
• Density: 1.51g/cm³
• LogP: 0.05750
• XLogP3: -0.8
• Hydrogen Bond Donor Count: 3
• Hydrogen Bond Acceptor Count: 7
• Rotatable Bond Count: 1
• Exact Mass: 378.16785316
• Heavy Atom Count: 27
• Complexity: 806

Purity/Quality:

99% ^*data from raw suppliers

14-Epitriptolide ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC(C)C1(C(C2C3(O2)C4(CCC5=C(C4CC6C3(C1O)O6)COC5=O)C)O)O