3-formamido-2-hydroxy-N-[(2S,5S,8S,13S,16R,17S)-8-isobutyl-13-isopropyl-3,6,9,11,14,18-hexaketo-2,10,10,16-tetramethyl-5-sec-butyl-1,4,12,15-tetraoxa-7-azacyclooctadec-17-yl]benzamide
Compound with spectra: 1 NMR
![3-formamido-2-hydroxy-N-[(2S,5S,8S,13S,16R,17S)-8-isobutyl-13-isopropyl-3,6,9,11,14,18-hexaketo-2,10,10,16-tetramethyl-5-sec-butyl-1,4,12,15-tetraoxa-7-azacyclooctadec-17-yl]benzamide](/api/compound/EQiHtUkVOvl.png?ph=true&h=300&w=458 "3-formamido-2-hydroxy-N-[(2S,5S,8S,13S,16R,17S)-8-isobutyl-13-isopropyl-3,6,9,11,14,18-hexaketo-2,10,10,16-tetramethyl-5-sec-butyl-1,4,12,15-tetraoxa-7-azacyclooctadec-17-yl]benzamide")
| SpectraBase Compound ID | EQiHtUkVOvl |
|---|---|
| InChI | InChI=1S/C36H51N3O13/c1-11-19(6)28-31(44)38-24(15-17(2)3)29(42)36(9,10)35(48)52-27(18(4)5)34(47)49-20(7)25(33(46)50-21(8)32(45)51-28)39-30(43)22-13-12-14-23(26(22)41)37-16-40/h12-14,16-21,24-25,27-28,41H,11,15H2,1-10H3,(H,37,40)(H,38,44)(H,39,43)/t19?,20-,21+,24+,25+,27+,28+/m1/s1 |
| InChIKey | NBVBHNUFSYRTEN-OQFKUZRZSA-N |
| Mol Weight | 733.8 g/mol |
| Molecular Formula | C36H51N3O13 |
| Exact Mass | 733.342189 g/mol |
| Enantiomer InChIKey | NBVBHNUFSYRTEN-OCWREICZSA-N |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
|---|---|
| Solvent | CD2Cl2 |
| Title | Journal or Book | Year |
|---|---|---|
| Antineoplastic Agents. 560. Isolation and Structure of Kitastatin 1 from an Alaskan Kitasatospora sp. | Journal of Natural Products | 2007 |