Pulcherralpin

Base Information

• Chemical Name: Pulcherralpin
• CAS No.: 105389-29-5
• Molecular Formula: C30H40 O7
• Molecular Weight: 512.63
• Wikidata: Q105218997
• ChEMBL ID: CHEMBL455618
• Mol file: 105389-29-5.mol

Synonyms:pulcherralpin

Chemical Property of Pulcherralpin

Chemical Property:

• Vapor Pressure: 1.01E-16mmHg at 25°C
• Boiling Point: 629.7°Cat760mmHg
• Flash Point: 199.2°C
• PSA: 110.13000
• Density: 1.22g/cm³
• LogP: 3.95420
• XLogP3: 4.1
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 7
• Rotatable Bond Count: 7
• Exact Mass: 512.27740361
• Heavy Atom Count: 37
• Complexity: 919

Purity/Quality:

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC1C(C(=O)CC2C1C(C(C3(C2(CCCC3(C)C)C)O)OC(=O)C=CC4=CC=CC=C4)O)CC(=O)OC
• Isomeric SMILES: C[C@H]1[C@@H](C(=O)C[C@H]2[C@H]1[C@H]([C@H]([C@@]3([C@@]2(CCCC3(C)C)C)O)OC(=O)/C=C/C4=CC=CC=C4)O)CC(=O)OC