SpectraBase Compound ID | JIQ4JBRXO8l |
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InChI | InChI=1S/C40H47N5O9/c1-24(2)18-19-53-31-16-12-29(13-17-31)21-33-40(52)54-34(22-27-8-6-5-7-9-27)39(51)43-25(3)36(48)41-23-35(47)44-32(20-28-10-14-30(46)15-11-28)38(50)42-26(4)37(49)45-33/h5-18,25-26,32-34,46H,19-23H2,1-4H3,(H,41,48)(H,42,50)(H,43,51)(H,44,47)(H,45,49)/t25-,26+,32+,33+,34-/m0/s1 |
InChIKey | JNXJCUUDHZAFNN-ZIWQVPDVSA-N |
Mol Weight | 741.8 g/mol |
Molecular Formula | C40H47N5O9 |
Exact Mass | 741.337378 g/mol |
SpectraBase Spectrum ID | GDLszX0DEAb |
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Name | PAECILODEPSIPEPTIDE_A |
Compound Number | 1 |
Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
Formula | C40H47N5O9 |
InChI | InChI=1S/C40H47N5O9/c1-24(2)18-19-53-31-16-12-29(13-17-31)21-33-40(52)54-34(22-27-8-6-5-7-9-27)39(51)43-25(3)36(48)41-23-35(47)44-32(20-28-10-14-30(46)15-11-28)38(50)42-26(4)37(49)45-33/h5-18,25-26,32-34,46H,19-23H2,1-4H3,(H,41,48)(H,42,50)(H,43,51)(H,44,47)(H,45,49)/t25-,26+,32+,33+,34-/m0/s1 |
InChIKey | JNXJCUUDHZAFNN-ZIWQVPDVSA-N |
Literature Reference Author | M.ISAKA,S.PALASARN,S.LAPANUN,K.SRIKLUNG |
Literature Reference Citation | J.NAT.PROD.,70,675(2007) |
Literature Reference DOI | 10.1021/np060602h |
Molecular Weight | 741.841 g/mol |
Sample ID | 30194 |
Solvent | DMSO-D6 |