| SpectraBase Compound ID | 16vCCHsflnx |
|---|---|
| InChI | InChI=1S/C40H64O12/c1-21-17-29-9-13-34(49-29)26(6)38(42)46-23(3)19-31-11-15-36(51-31)28(8)40(44)48-24(4)20-32-12-16-35(52-32)27(7)39(43)47-22(2)18-30-10-14-33(50-30)25(5)37(41)45-21/h21-36H,9-20H2,1-8H3 |
| InChIKey | RMIXHJPMNBXMBU-UHFFFAOYSA-N |
| Mol Weight | 736.9 g/mol |
| Molecular Formula | C40H64O12 |
| Exact Mass | 736.439777 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | H752WA8ZiPW |
|---|---|
| Name | Nonactin |
| CAS Registry Number | 6833-84-7 |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C40H64O12 |
| InChI | InChI=1S/C40H64O12/c1-21-17-29-9-13-34(49-29)26(6)38(42)46-23(3)19-31-11-15-36(51-31)28(8)40(44)48-24(4)20-32-12-16-35(52-32)27(7)39(43)47-22(2)18-30-10-14-33(50-30)25(5)37(41)45-21/h21-36H,9-20H2,1-8H3 |
| InChIKey | RMIXHJPMNBXMBU-UHFFFAOYSA-N |
| Molecular Weight | 736.940 g/mol |
| SMILES | CC1C2OC(CC(C)OC(=O)C(C)C3OC(CC(C)OC(=O)C(C)C4OC(CC(C)OC(C(C5OC(CC(C)OC1=O)CC5)C)=O)CC4)CC3)CC2 |
| SPLASH | splash10-014r-3901100000-6b4a6fad6fc9d70b56db |
| Source of Spectrum | KZ-221-353-7 |
| Synonyms | 4,13,22,31,37,38,39,40-Octaoxapentacyclo(32.2.1.1(sup 7,10).1(sup 16,19).1(sup 25,28))tetracontane-3,12,21,30-tetrone, 2,5,11,14,20,23,29,32-octamethyl-, (1R-(1R*,2R*,5R*,7R*,10S*,11S*,14S*,16S*,19R*,20R*,23R*,25R*,28S*,29S*,32S*,34S*))- 4,13,22,31,37,38,39,40-Octaoxapentacyclo[32.2.1.1(7,10).1(16,19).1(25,28)]tetracontane-3,12,21,30-tetrone, 2,5,11,14,20,23,29,32-octamethyl- 4,13,22,31,37,38,39,40-Octaoxapentacyclo[32.2.1.1(7,10).1(16,19).1(25,28)]tetracontane-3,12,21,30-tetrone, 2,5,11,14,20,23,29,32-octamethyl-, [1R-(1R*,2R*,5R*,7R*,10S*,11S*,14S*,16S*,19R*,20R*,23R*,25R*,28S*,29S*,32S*,34S*)]- 4,13,22,31,37,38,39,40-Octaoxapentacyclo[32.2.1.1(7,10).1(16,19).1(25,28)]tetracontane-3,12,21,30-tetrone, 2,5,11,14,20,23,29,32-octamethyl-, [1R-(1R,2R,5R,7R,10S,11S,14S,16S,19R,20R,23R,25R,28S,29S,32S,34S)]- Antibiotic from Actinomycete E-79-C N-329-A TA-25-M-I Upjohn 170t (high melting) Werramycin-A 3584-A 5342 PFW 19 A 4426 A-5584 BRN 0076434 EINECS 229-911-3 FH-3582-A NSC 52141 NSC 56409 |
| Wiley ID | 1416044 |