Chemical Property of Circulin B
Chemical Property:
- Vapor Pressure:0mmHg at 25°C
- Boiling Point:1537.1°Cat760mmHg
- Flash Point:883.4°C
- PSA：490.66000
- Density:1.26g/cm3
- LogP:1.53520
- XLogP3:-3.3
- Hydrogen Bond Donor Count:18
- Hydrogen Bond Acceptor Count:18
- Rotatable Bond Count:28
- Exact Mass:1154.74992724
- Heavy Atom Count:81
- Complexity:2050
- Purity/Quality:
-
98% *data from raw suppliers
Safty Information:
- Pictogram(s):
- Hazard Codes:
- MSDS Files:
-
Useful:
- Canonical SMILES:CCC(C)C1C(=O)NC(C(=O)NC(C(=O)NC(C(=O)NCCC(C(=O)NC(C(=O)NC(C(=O)N1)CC(C)C)CCN)NC(=O)C(CCN)NC(=O)C(C(C)O)NC(=O)C(CCN)NC(=O)CCCCC(C)C)C(C)O)CCN)CCN
- Isomeric SMILES:CC[C@H](C)[C@H]1C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)NCC[C@@H](C(=O)N[C@H](C(=O)N[C@@H](C(=O)N1)CC(C)C)CCN)NC(=O)[C@H](CCN)NC(=O)[C@H]([C@@H](C)O)NC(=O)[C@H](CCN)NC(=O)CCCCC(C)C)[C@@H](C)O)CCN)CCN
