| SpectraBase Compound ID | 53mKJDulkb |
|---|---|
| InChI | InChI=1S/C41H57NO8/c1-28-18-12-8-11-15-23-39(47)50-40(32(5)37(46)25-31(4)43)29(2)19-13-9-10-14-21-35(44)26-38(48-7)33(6)41-42-34(27-49-41)20-16-17-22-36(45)30(3)24-28/h8-24,27,29-33,35-38,40,43-46H,25-26H2,1-7H3/b10-9+,11-8+,18-12-,19-13-,20-16+,21-14+,22-17-,23-15-,28-24+ |
| InChIKey | ATQKOUYCGKRYRF-GDDXYXLTSA-N |
| Mol Weight | 691.9 g/mol |
| Molecular Formula | C41H57NO8 |
| Exact Mass | 691.408418 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | 3iYTHZ0obPn |
|---|---|
| Name | Chivosazole F |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C41H57NO8 |
| InChI | InChI=1S/C41H57NO8/c1-28-18-12-8-11-15-23-39(47)50-40(32(5)37(46)25-31(4)43)29(2)19-13-9-10-14-21-35(44)26-38(48-7)33(6)41-42-34(27-49-41)20-16-17-22-36(45)30(3)24-28/h8-24,27,29-33,35-38,40,43-46H,25-26H2,1-7H3/b10-9+,11-8+,18-12-,19-13-,20-16+,21-14+,22-17-,23-15-,28-24+ |
| InChIKey | ATQKOUYCGKRYRF-GDDXYXLTSA-N |
| Molecular Weight | 691.906 g/mol |
| SMILES | OC1\C=C\C=C\C=C/C(C(C(C(CC(O)C)O)C)OC(\C=C/C=C/C=C\C(=C\C(C(\C=C/C=C/c2nc(C(C(C1)OC)C)oc2)O)C)C)=O)C |
| SPLASH | splash10-00di-0523209000-d04a462faa3b4c7d5bc0 |
| Source of Spectrum | U-1997-1731-7 |
| Synonyms | (2E,4Z,8E,10Z,12E,14Z,20Z,22E,24E)-18-(2,4-dihydroxy-1-methyl-pentyl)-6,26-dihydroxy-28-methoxy-7,9,19,29-tetramethyl-17,31-dioxa-33-azabicyclo[28.2.1]tritriaconta-1(32),2,4,8,10,12,14,20,22,24,30(33)-undecaen-16-one (2E,4Z,8E,10Z,12E,14Z,20Z,22E,24E)-18-(3,5-dihydroxyhexan-2-yl)-6,26-dihydroxy-28-methoxy-7,9,19,29-tetramethyl-17,31-dioxa-33-azabicyclo[28.2.1]tritriaconta-1(32),2,4,8,10,12,14,20,22,24,30(33)-undecaen-16-one (2E,4Z,8E,10Z,12E,14Z,20Z,22E,24E)-18-[3,5-bis(oxidanyl)hexan-2-yl]-28-methoxy-7,9,19,29-tetramethyl-6,26-bis(oxidanyl)-17,31-dioxa-33-azabicyclo[28.2.1]tritriaconta-1(32),2,4,8,10,12,14,20,22,24,30(33)-undecaen-16-one |
| Wiley ID | 770078 |