Partricin-A der.

Base Information

• Chemical Name: Partricin-A der.
• CAS No.: 143563-20-6
• Molecular Formula: C7H7NO4•1/2C67H103N5O19
• Molecular Weight: 810.43
• European Community (EC) Number: 812-947-4
• Mol file: 143563-20-6.mol

Synonyms:N-dimethylaminoacetyl-partricin A 2-dimethylaminoethylamide diaspartate;SPA-S-753

Chemical Property of Partricin-A der.

Chemical Property:

• Vapor Pressure: 0mmHg at 25°C
• Boiling Point: 1375.5°C at 760 mmHg
• Flash Point: 785.6°C
• Hydrogen Bond Donor Count: 19
• Hydrogen Bond Acceptor Count: 32
• Rotatable Bond Count: 23
• Exact Mass: 1547.79974148
• Heavy Atom Count: 109
• Complexity: 2560

Purity/Quality:

99% ^*data from raw suppliers

Safty Information:

• Pictogram(s): A poison.
• Hazard Codes: A poison.

MSDS Files:

Useful:

• Canonical SMILES: CC1C=CC=CC=CC=CC=CC=CC=CC(CC2C(C(CC(O2)(CC(CC(CC(CC(CC(=O)CC(CC(=O)OC1C(C)CCC(CC(=O)C3=CC=C(C=C3)NC)O)O)O)O)O)O)O)O)C(=O)NCCN(C)C)OC4C(C(C(C(O4)C)O)NC(=O)CN(C)C)O.C(C(C(=O)O)N)C(=O)O.C(C(C(=O)O)N)C(=O)O
• Isomeric SMILES: C[C@@H]1[C@H]([C@@H]([C@@H]([C@@H](O1)O[C@@H]\2C[C@H]3[C@@H]([C@H](C[C@](O3)(C[C@H](C[C@H](C[C@H](C[C@H](CC(=O)C[C@H](CC(=O)OC(C(/C=C/C=C/C=C\C=C/C=C/C=C/C=C2)C)[C@@H](C)CCC(CC(=O)C4=CC=C(C=C4)NC)O)O)O)O)O)O)O)O)C(=O)NCCN(C)C)O)NC(=O)CN(C)C)O.C([C@@H](C(=O)O)N)C(=O)O.C([C@@H](C(=O)O)N)C(=O)O