| SpectraBase Compound ID | IsXLgaxm2kJ |
|---|---|
| InChI | InChI=1S/C30H42BrNO4/c1-8-9-10-11-12-16-19-26(34)27(31)22(2)17-14-13-15-18-23(3)28(35)30(6,7)29(36)32-24(4)20-21-25(5)33/h10-18,24,26,28,34-35H,19-21H2,1-7H3,(H,32,36)/b11-10-,15-13-,16-12+,17-14+,23-18-,27-22- |
| InChIKey | SZVQGLINIKUCIF-VZNLWGDBSA-N |
| Mol Weight | 560.6 g/mol |
| Molecular Formula | C30H42BrNO4 |
| Exact Mass | 559.229722 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | A2AYXjVePsY |
|---|---|
| Name | Clathrynamide C |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C30H42BrNO4 |
| InChI | InChI=1S/C30H42BrNO4/c1-8-9-10-11-12-16-19-26(34)27(31)22(2)17-14-13-15-18-23(3)28(35)30(6,7)29(36)32-24(4)20-21-25(5)33/h10-18,24,26,28,34-35H,19-21H2,1-7H3,(H,32,36)/b11-10-,15-13-,16-12+,17-14+,23-18-,27-22- |
| InChIKey | SZVQGLINIKUCIF-VZNLWGDBSA-N |
| Molecular Weight | 560.573 g/mol |
| SMILES | N(C(C(C(\C(=C/C=C\C=C\C(=C\(C(O)C\C=C\C=C/C#CC)Br)C)C)O)(C)C)=O)C(CCC(=O)C)C |
| SPLASH | splash10-0006-9300000000-dd2a9a3943b55d50984d |
| Source of Spectrum | AT-34-5938-3 |
| Synonyms | (4Z,6Z,8E,10Z,14E,16Z)-11-bromo-3,12-dihydroxy-2,2,4,10-tetramethyl-N-(5-oxohexan-2-yl)eicosa-4,6,8,10,14,16-hexaen-18-ynamide (4Z,6Z,8E,10Z,14E,16Z)-11-bromo-3,12-dihydroxy-2,2,4,10-tetramethyl-N-(5-oxohexan-2-yl)icosa-4,6,8,10,14,16-hexaen-18-ynamide (4Z,6Z,8E,10Z,14E,16Z)-11-bromo-3,12-dihydroxy-2,2,4,10-tetramethyl-N-(1-methyl-4-oxo-pentyl)icosa-4,6,8,10,14,16-hexaen-18-ynamide (4Z,6Z,8E,10Z,14E,16Z)-11-bromanyl-2,2,4,10-tetramethyl-3,12-bis(oxidanyl)-N-(5-oxidanylidenehexan-2-yl)icosa-4,6,8,10,14,16-hexaen-18-ynamide |
| Wiley ID | 852624 |