Auriculin B

Base Information

• Chemical Name: Auriculin B
• CAS No.: 90052-57-6
• Molecular Formula: C113H177 N39 O35 S2
• Molecular Weight: 2705.98
• DSSTox Substance ID: DTXSID20583209
• Mol file: 90052-57-6.mol

Synonyms:anaritide;anaritide acetate;anaritide, rat reduced ANF;ANF (102-126);ANF 25;ANF IV;atrial natriuretic factor (102-126);atrial natriuretic factor 25;atrial natriuretic factor prohormone (102-126);atrial natriuretic factor, Arg(102)-Tyr(126)-;atriopeptin 25;auriculin B;Wy 47663;WY 47987;WY-47,663;Wy-47663;WY-47987

Chemical Property of Auriculin B

Chemical Property:

• PSA: 1284.55000
• LogP: -1.93210
• Storage Temp.: -15°C
• XLogP3: -12.9
• Hydrogen Bond Donor Count: 46
• Hydrogen Bond Acceptor Count: 42
• Rotatable Bond Count: 60
• Exact Mass: 2705.2744257
• Heavy Atom Count: 189
• Complexity: 6040

Purity/Quality:

99% ^*data from raw suppliers

AURICULIN B 95.00% ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CCC(C)C1C(=O)NCC(=O)NC(C(=O)NC(C(=O)NC(C(=O)NCC(=O)NC(C(=O)NCC(=O)NC(CSSCC(C(=O)NC(C(=O)NCC(=O)NCC(=O)NC(C(=O)NC(C(=O)NC(C(=O)NC(C(=O)N1)CCCNC(=N)N)CC(=O)O)C(C)CC)CCCNC(=N)N)CC2=CC=CC=C2)NC(=O)C(CO)NC(=O)C(CO)NC(=O)C(CCCNC(=N)N)N)C(=O)NC(CC(=O)N)C(=O)NC(CO)C(=O)NC(CC3=CC=CC=C3)C(=O)NC(CCCNC(=N)N)C(=O)NC(CC4=CC=C(C=C4)O)C(=O)O)CC(C)C)CO)CCC(=O)N)C
• Isomeric SMILES: CC[C@H](C)[C@H]1C(=O)NCC(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)NCC(=O)N[C@H](C(=O)NCC(=O)N[C@@H](CSSC[C@@H](C(=O)N[C@H](C(=O)NCC(=O)NCC(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N1)CCCNC(=N)N)CC(=O)O)[C@@H](C)CC)CCCNC(=N)N)CC2=CC=CC=C2)NC(=O)[C@H](CO)NC(=O)[C@H](CO)NC(=O)[C@H](CCCNC(=N)N)N)C(=O)N[C@@H](CC(=O)N)C(=O)N[C@@H](CO)C(=O)N[C@@H](CC3=CC=CC=C3)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CC4=CC=C(C=C4)O)C(=O)O)CC(C)C)CO)CCC(=O)N)C