(17Z,19Z,21Z,23Z,25Z)-4,6,10,12,14,16-hexahydroxy-3,15,27,28-tetramethyl-1-oxacyclooctacosa-17,19,21,23,25-pentaen-2-one

Base Information

• Chemical Name: (17Z,19Z,21Z,23Z,25Z)-4,6,10,12,14,16-hexahydroxy-3,15,27,28-tetramethyl-1-oxacyclooctacosa-17,19,21,23,25-pentaen-2-one
• CAS No.: 141443-39-2
• Molecular Formula: C31H50 O8
• Molecular Weight: 550.7239
• Hs Code.: 29419000
• Nikkaji Number: J534.545F
• Mol file: 141443-39-2.mol

Synonyms:141443-39-2;(17Z,19Z,21Z,23Z,25Z)-4,6,10,12,14,16-hexahydroxy-3,15,27,28-tetramethyl-1-oxacyclooctacosa-17,19,21,23,25-pentaen-2-one;AB023a;Antibiotic AB 023a;AB-023a;Oxacyclooctacosa-17,19,21,23,25-pentaen-2-one, 4,6,10,12,14,16-hexahydroxy-3,15,27,28-tetramethyl- (9CI)

Chemical Property of (17Z,19Z,21Z,23Z,25Z)-4,6,10,12,14,16-hexahydroxy-3,15,27,28-tetramethyl-1-oxacyclooctacosa-17,19,21,23,25-pentaen-2-one

Chemical Property:

• Vapor Pressure: 1.98E-28mmHg at 25°C
• Boiling Point: 784.4°C at 760 mmHg
• Flash Point: 246.6°C
• PSA: 147.68000
• Density: 1.074g/cm³
• LogP: 3.12700
• XLogP3: 4.4
• Hydrogen Bond Donor Count: 6
• Hydrogen Bond Acceptor Count: 8
• Rotatable Bond Count: 0
• Exact Mass: 550.35056855
• Heavy Atom Count: 39
• Complexity: 832

Purity/Quality:

AB-023A 95.00% ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC1C=CC=CC=CC=CC=CC(C(C(CC(CC(CCCC(CC(C(C(=O)OC1C)C)O)O)O)O)O)C)O
• Isomeric SMILES: CC1/C=C\C=C/C=C\C=C/C=C\C(C(C(CC(CC(CCCC(CC(C(C(=O)OC1C)C)O)O)O)O)O)C)O