| SpectraBase Compound ID | BtGlY385GgZ |
|---|---|
| InChI | InChI=1S/C50H78N12O14/c1-28(2)12-9-7-5-3-4-6-8-10-13-30-23-43(69)56-34(24-40(52)66)45(71)58-33(22-29-15-17-31(64)18-16-29)44(70)59-35(25-41(53)67)46(72)57-32(19-20-39(51)65)50(76)62-21-11-14-38(62)49(75)60-36(26-42(54)68)47(73)61-37(27-63)48(74)55-30/h15-18,28,30,32-38,63-64H,3-14,19-27H2,1-2H3,(H2,51,65)(H2,52,66)(H2,53,67)(H2,54,68)(H,55,74)(H,56,69)(H,57,72)(H,58,71)(H,59,70)(H,60,75)(H,61,73) |
| InChIKey | KKIVMGDDVLIFLL-UHFFFAOYSA-N |
| Mol Weight | 1071.2 g/mol |
| Molecular Formula | C50H78N12O14 |
| Exact Mass | 1070.576045 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 2fP1rBA9cEW |
|---|---|
| Name | ITURIN-A6 |
| Compound Number | 5 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C50H78N12O14 |
| InChI | InChI=1S/C50H78N12O14/c1-28(2)12-9-7-5-3-4-6-8-10-13-30-23-43(69)56-34(24-40(52)66)45(71)58-33(22-29-15-17-31(64)18-16-29)44(70)59-35(25-41(53)67)46(72)57-32(19-20-39(51)65)50(76)62-21-11-14-38(62)49(75)60-36(26-42(54)68)47(73)61-37(27-63)48(74)55-30/h15-18,28,30,32-38,63-64H,3-14,19-27H2,1-2H3,(H2,51,65)(H2,52,66)(H2,53,67)(H2,54,68)(H,55,74)(H,56,69)(H,57,72)(H,58,71)(H,59,70)(H,60,75)(H,61,73) |
| InChIKey | KKIVMGDDVLIFLL-UHFFFAOYSA-N |
| Literature Reference Author | S.HIRADATE,S.YOSHIDA,H.SUGIE,H.YADA,Y.FUJII |
| Literature Reference Citation | PHYTOCHEM.,61,693(2002) |
| Literature Reference DOI | 10.1016/S0031-9422(02)00365-5 |
| Molecular Weight | 1071.241 g/mol |
| Solvent | DMSO-D6 |
| Source File Reference | UWLU29442 |