Pectenotoxin 2
14-(2,3-dihydroxy-4-methyloxan-2-yl)-28-hydroxy-5,7,9,19,29,35-hexamethyl-13,17,38,39,40,41,42,43-octaoxaoctacyclo[31.4.1.11,35.12,5.120,24.124,27.129,32.012,16]tritetraconta-8,10-diene-18,31-dione
Also Known As: Pectenotoxin 2|Pectenotoxin II|Pectenotoxin-2|43-Dioxypectenotoxin
CAS: 97564-91-5
| Molecular Formula | C47H70O14 |
|---|---|
| Molecular Weight | 858.47656 g/mol |
| LogP | 5.254 |
| Topological Polar Surface Area | 177.9 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 14 |
| Rotatable Bonds | 1 |
| Exact Mass | 858.47656 |
| Monoisotopic Mass | 858.47656 |
| Heavy Atoms | 61 |
| Complexity | 1754.047 |
Chemical Identifiers
| CAS Number | 97564-91-5 |
|---|---|
| SMILES | CC1CCOC(C1O)(C2CC3C(O2)C=CC(=CC(CC4(CCC(O4)C56CCC(O5)(CC(O6)C7C(=O)CC(O7)(C(C8CCC9(O8)CCCC(O9)C(C(=O)O3)C)O)C)C)C)C)C)O |
Product Overview
Pectenotoxin 2 (CAS 97564-91-5), with molecular formula C47H70O14 and molecular weight 858.47656 g/mol. IUPAC: 14-(2,3-dihydroxy-4-methyloxan-2-yl)-28-hydroxy-5,7,9,19,29,35-hexamethyl-13,17,38,39,40,41,42,43-octaoxaoctacyclo[31.4.1.11,35.12,5.120,24.124,27.129,32.012,16]tritetraconta-8,10-diene-18,31-dione.
Safety Data Sheet (MSDS / SDS)
View the Laboratory Chemical Safety Summary (LCSS) on PubChem — includes GHS classifications, hazard statements, first aid measures, and handling precautions.
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