| SpectraBase Compound ID | 41uTKd4RIGK |
|---|---|
| InChI | InChI=1S/C49H65N7O7/c1-8-33(4)43-45(59)51-37(27-32(2)3)46(60)55(7)41(30-36-23-16-11-17-24-36)49(63)56-26-18-25-39(56)48(62)53(5)31-42(57)50-38(28-34-19-12-9-13-20-34)47(61)54(6)40(44(58)52-43)29-35-21-14-10-15-22-35/h9-17,19-24,32-33,37-41,43H,8,18,25-31H2,1-7H3,(H,50,57)(H,51,59)(H,52,58)/t33-,37+,38+,39+,40+,41-,43+/m1/s1 |
| InChIKey | UVPLWQIDJSLMEL-WINZVFLBSA-N |
| Mol Weight | 864.1 g/mol |
| Molecular Formula | C49H65N7O7 |
| Exact Mass | 863.494547 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 1YJUGi2eiKm |
|---|---|
| Name | CORDYHEPTAPEPTIDE_B |
| Compound Number | 16 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C49H65N7O7 |
| InChI | InChI=1S/C49H65N7O7/c1-8-33(4)43-45(59)51-37(27-32(2)3)46(60)55(7)41(30-36-23-16-11-17-24-36)49(63)56-26-18-25-39(56)48(62)53(5)31-42(57)50-38(28-34-19-12-9-13-20-34)47(61)54(6)40(44(58)52-43)29-35-21-14-10-15-22-35/h9-17,19-24,32-33,37-41,43H,8,18,25-31H2,1-7H3,(H,50,57)(H,51,59)(H,52,58)/t33-,37+,38+,39+,40+,41-,43+/m1/s1 |
| InChIKey | UVPLWQIDJSLMEL-WINZVFLBSA-N |
| Literature Reference Author | M.ISAKA,U.SRISANOH,N.LARTPORNMATULEE,T.BOONRUANGPRAPA |
| Literature Reference Citation | J.NAT.PROD.,70,1601(2007) |
| Literature Reference DOI | 10.1021/np070357h |
| Molecular Weight | 864.098 g/mol |
| Sample ID | 31675 |
| Solvent | CDCl3 |