| SpectraBase Compound ID | 48AABzQOMRc |
|---|---|
| InChI | InChI=1S/C20H41N5O10.5C2H4O2/c1-6-10(24)17(31-3-2-26)15(30)20(32-6)35-18-12(27)7(22)4-8(23)16(18)34-19-11(25)14(29)13(28)9(5-21)33-19;5*1-2(3)4/h6-20,26-30H,2-5,21-25H2,1H3;5*1H3,(H,3,4)/t6-,7+,8-,9+,10-,11+,12-,13+,14+,15-,16+,17+,18+,19+,20+;;;;;/m0...../s1 |
| InChIKey | YJYQERMFHDUZLQ-GLQKDOBFSA-N |
| Mol Weight | 811.833 g/mol |
| Molecular Formula | C30H61N5O20 |
| Exact Mass | 811.390989 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 4uTrUvm2Zav |
|---|---|
| Name | YJYQERMFHDUZLQ-GLQKDOBFSA-N |
| Compound Number | TC028 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C30H61N5O20 |
| InChI | InChI=1S/C20H41N5O10.5C2H4O2/c1-6-10(24)17(31-3-2-26)15(30)20(32-6)35-18-12(27)7(22)4-8(23)16(18)34-19-11(25)14(29)13(28)9(5-21)33-19;5*1-2(3)4/h6-20,26-30H,2-5,21-25H2,1H3;5*1H3,(H,3,4)/t6-,7+,8-,9+,10-,11+,12-,13+,14+,15-,16+,17+,18+,19+,20+;;;;;/m0...../s1 |
| InChIKey | YJYQERMFHDUZLQ-GLQKDOBFSA-N |
| Literature Reference Author | J.LI,J.WANG,Y.HUI,C.T.CHANG |
| Literature Reference Citation | ORG.LETTERS,5,431(2003) |
| Literature Reference DOI | 10.1021/ol027288c |
| Molecular Weight | 811.836 g/mol |
| Sample ID | 49433 |
| Solvent | D2O |