| SpectraBase Compound ID | 1PW85mzO9XV |
|---|---|
| InChI | InChI=1S/C45H71N7O10/c1-12-16-34(53)48-36(26(6)7)41(57)50-38-28(10)62-45(61)37(27(8)9)49-40(56)32(23-29-17-14-13-15-18-29)51(11)44(60)33(22-25(4)5)52-35(54)20-19-30(43(52)59)46-39(55)31(21-24(2)3)47-42(38)58/h13-15,17-18,24-28,30-33,35-38,54H,12,16,19-23H2,1-11H3,(H,46,55)(H,47,58)(H,48,53)(H,49,56)(H,50,57)/t28-,30+,31+,32+,33+,35-,36-,37+,38+/m1/s1 |
| InChIKey | RUCVBGWUPBXPNT-WHEHQOQMSA-N |
| Mol Weight | 870.1 g/mol |
| Molecular Formula | C45H71N7O10 |
| Exact Mass | 869.526242 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | JR65IKHPNwT |
|---|---|
| Name | TASIPEPTIN-A |
| Compound Number | 1 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C45H71N7O10 |
| InChI | InChI=1S/C45H71N7O10/c1-12-16-34(53)48-36(26(6)7)41(57)50-38-28(10)62-45(61)37(27(8)9)49-40(56)32(23-29-17-14-13-15-18-29)51(11)44(60)33(22-25(4)5)52-35(54)20-19-30(43(52)59)46-39(55)31(21-24(2)3)47-42(38)58/h13-15,17-18,24-28,30-33,35-38,54H,12,16,19-23H2,1-11H3,(H,46,55)(H,47,58)(H,48,53)(H,49,56)(H,50,57)/t28-,30+,31+,32+,33+,35-,36-,37+,38+/m1/s1 |
| InChIKey | RUCVBGWUPBXPNT-WHEHQOQMSA-N |
| Literature Reference Author | P.G.WILLIAMS,W.Y.YOSHIDA,R.E.MOORE,V.J.PAUL |
| Literature Reference Citation | J.NAT.PROD.,66,620(2003) |
| Literature Reference DOI | 10.1021/np020582t |
| Molecular Weight | 870.100 g/mol |
| Solvent | CDCl3 |
| Source File Reference | UWSI7708 |