Vitamin D2 3-glucuronide

Base Information

• Chemical Name: Vitamin D2 3-glucuronide
• CAS No.: 57803-96-0
• Molecular Formula: C34H52 O7
• Molecular Weight: 572.77
• Mol file: 57803-96-0.mol

Synonyms:vitamin D2 3 beta-glucosiduronate;vitamin D2 3-glucuronide;vitamin D2 glucosiduronate

Chemical Property of Vitamin D2 3-glucuronide

Chemical Property:

• Vapor Pressure: 4.39E-23mmHg at 25°C
• Boiling Point: 706.7°Cat760mmHg
• Flash Point: 216.9°C
• PSA: 116.45000
• Density: 1.17g/cm³
• LogP: 5.55750
• XLogP3: 6.1
• Hydrogen Bond Donor Count: 4
• Hydrogen Bond Acceptor Count: 7
• Rotatable Bond Count: 8
• Exact Mass: 572.37130399
• Heavy Atom Count: 41
• Complexity: 1040

Purity/Quality:

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC(C)C(C)C=CC(C)C1CCC2C1(CCCC2=CC=C3CC(CCC3=C)OC4C(C(C(C(O4)C(=O)O)O)O)O)C
• Isomeric SMILES: C[C@H](/C=C/[C@H](C)C(C)C)[C@H]1CCC\2[C@@]1(CCC/C2=C\C=C\3/CC(CCC3=C)O[C@H]4[C@@H]([C@H]([C@@H]([C@H](O4)C(=O)O)O)O)O)C