PHAKELLISTATIN_16;CYCLO-(PRO-PHE-ASP-SER-ARG-ALA-VAL-THR-TYR);MAJOR_ISOMER
Compound with spectra: 2 NMR
| SpectraBase Compound ID | BQIkeDM522g |
|---|---|
| InChI | InChI=1S/C48H68N12O14/c1-24(2)37-45(72)59-38(26(4)62)46(73)56-33(21-28-14-16-29(63)17-15-28)47(74)60-19-9-13-35(60)44(71)55-31(20-27-10-6-5-7-11-27)41(68)54-32(22-36(64)65)42(69)57-34(23-61)43(70)53-30(12-8-18-51-48(49)50)40(67)52-25(3)39(66)58-37/h5-7,10-11,14-17,24-26,30-35,37-38,61-63H,8-9,12-13,18-23H2,1-4H3,(H,52,67)(H,53,70)(H,54,68)(H,55,71)(H,56,73)(H,57,69)(H,58,66)(H,59,72)(H,64,65)(H4,49,50,51)/t25-,26?,30-,31-,32-,33-,34-,35-,37-,38-/m0/s1 |
| InChIKey | HWZJEQDZVPMMCZ-AEOBKWRRSA-N |
| Mol Weight | 1037.1 g/mol |
| Molecular Formula | C48H68N12O14 |
| Exact Mass | 1036.497795 g/mol |
| Enantiomer InChIKey | HWZJEQDZVPMMCZ-WAAJHLJKSA-N |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
|---|---|
| Solvent | DMSO-D6 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
|---|---|
| Solvent | DMSO-D6 |
- PHAKELLISTATIN_16;CYCLO-(PRO-PHE-ASP-SER-ARG-ALA-VAL-THR-TYR);MINOR_ISOMER
DICHOTOMIN-H;CYClO-(-ALA-PRO-THR-PHE-TYR-PRO-LEU-ILE-)
STYLISSMIDE_F;CYCLO-(TRANS-PRO-(1)-CIS-PRO-(2)-PHE-(3)-ASP-(4)-TRANS-PRO-(5)-ARG-(6)-PHE-(7))
PRENYLAGARAMIDE-B;CYClO-(PTYR-LEU-TYR-PRO-ILE-ASN-PRO)
DRYMARIN_A
STYLISSMIDE_E;CYCLO-(CIS-PRO-(1)-TYR-(2)-TRANS-PRO-(3)-ALA-(4)-ILE-(5)-GLN-(6)-ILE-(7))
STYLOPEPTIDE_2
PHAKELLIASTATIN
INTEGERRIMIDE_B;TRANS-CONFORMER;CYCLO-(-TRP-(1)-ALA-(2)-LEU-(3)-LEU-(4)-VAL-(5)-SER-(6)-PRO-(7)-)
XENTRIVALPEPTIDE_D
XENTRIVALPEPTIDE_A
| Title | Journal or Book | Year |
|---|---|---|
| Proline-Containing Cyclopeptides from the Marine Sponge Phakellia fusca | Journal of Natural Products | 2010 |
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.