Pyrromycin

Base Information

• Chemical Name: Pyrromycin
• CAS No.: 668-17-7
• Molecular Formula: C30H35 N O11
• Molecular Weight: 585.608
• Nikkaji Number: J14.232H
• Wikidata: Q76084760
• Metabolomics Workbench ID: 73618
• ChEMBL ID: CHEMBL3039044
• Mol file: 668-17-7.mol

Synonyms:pyrromycin

Chemical Property of Pyrromycin

Chemical Property:

• Vapor Pressure: 2.39E-23mmHg at 25°C
• Boiling Point: 745.6°C at 760 mmHg
• Flash Point: 404.7°C
• PSA: 183.29000
• Density: 1.5g/cm³
• LogP: 1.86390
• XLogP3: 3.3
• Hydrogen Bond Donor Count: 5
• Hydrogen Bond Acceptor Count: 12
• Rotatable Bond Count: 6
• Exact Mass: 585.22101093
• Heavy Atom Count: 42
• Complexity: 1050

Purity/Quality:

99%, ^*data from raw suppliers

PYRROMYCIN 95.00% ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CCC1(CC(C2=C(C3=C(C=C2C1C(=O)OC)C(=O)C4=C(C=CC(=C4C3=O)O)O)O)OC5CC(C(C(O5)C)O)N(C)C)O
• Isomeric SMILES: CC[C@]1(C[C@@H](C2=C(C3=C(C=C2[C@H]1C(=O)OC)C(=O)C4=C(C=CC(=C4C3=O)O)O)O)O[C@H]5C[C@@H]([C@@H]([C@@H](O5)C)O)N(C)C)O