SYMPLOSTATIN-3;MAJOR-CONFORMER
Compound with spectra: 2 NMR
| SpectraBase Compound ID | CqFDxJKpp9w |
|---|---|
| InChI | InChI=1S/C40H66N4O9/c1-13-26(6)35(43(10)38(47)33(24(2)3)41-37(46)34(25(4)5)42(8)9)30(51-11)23-32(45)44-21-17-20-29(44)36(52-12)27(7)40(50)53-31(39(48)49)22-28-18-15-14-16-19-28/h14-16,18-19,24-27,29-31,33-36H,13,17,20-23H2,1-12H3,(H,41,46)(H,48,49)/t26-,27+,29-,30+,31+,33-,34-,35-,36+/m1/s1 |
| InChIKey | PFMWLSLCVYOPSJ-CIMAXFCCSA-N |
| Mol Weight | 747.0 g/mol |
| Molecular Formula | C40H66N4O9 |
| Exact Mass | 746.48298 g/mol |
| Enantiomer InChIKey | PFMWLSLCVYOPSJ-UJFJUDRFSA-N |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
|---|---|
| Solvent | CD3OD |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
|---|---|
| Solvent | CD3OD |
- SYMPLOSTATIN-3;MINOR-CONFORMER
2-EPI-ISODOLASTATIN-H
ISODOLASTATIN-H
2-EPI-DOLASTATIN-H
MORPHOLINE_AURISTATIN_TP
TRIS_AURISTATIN_TP
_AURISTATIN_TPBENZYLPHOSPHORYLOXY)-PHENETHYLAMIDE;ISOMER_2
SERINE_AURISTATIN_TP
Propanamide, 2-(dimethylamino)-N-[2-methyl-1-[[3,3a,12,13,14,15,16,16a-octahydro-8-methoxy-13,16-dioxo-14-(phenylmethyl)-5,9-metheno-9H-pyrrolo[3,2-b][1,5,8]oxadiazacyclopentadecin-1(2H)-yl]carbonyl]propyl]-
Pentanamide, 2-(dimethylamino)-4-methyl-N-[2-methyl-1-[[3,3a,11,12,13,14,15,15a-octahydro-12,15-dioxo-13-(phenylmethyl)-5,8-ethenopyrrolo[3,2-b][1,5,8]oxadiazacyclotetradecin-1(2H)-yl]carbonyl]butyl]-
VERAGUAMIDE_B
| Title | Journal or Book | Year |
|---|---|---|
| Symplostatin 3, a New Dolastatin 10 Analogue from the Marine Cyanobacterium Symploca sp. VP452 | Journal of Natural Products | 2001 |
This compound is available in the following databases:
KnowItAll NMR Spectral Library
Author: Wiley
The KnowItAll NMR Spectral Library offers a comprehensive collection of NMR reference spectra, including NMR, CNMR, and XNMR, and covers a wide range of compounds including organics, polymers, monomers, metabolites, and more. Learn more.