![[4-O-BENZOYL-2,6-DIDEOXY-2-IODO-ALPHA-L-MANNO-HEXOPYRANOSYL]-(1->6)-1,2,3,4-TETRA-O-PIVALOYL-BETA-D-MANNOPYRANOSIDE](/api/spectrum/7AYU0QptzYP/structure.png?h=300&w=458 "[4-O-BENZOYL-2,6-DIDEOXY-2-IODO-ALPHA-L-MANNO-HEXOPYRANOSYL]-(1->6)-1,2,3,4-TETRA-O-PIVALOYL-BETA-D-MANNOPYRANOSIDE")
| SpectraBase Compound ID | AmIdNTeKQn9 |
|---|---|
| InChI | InChI=1S/C39H57IO14/c1-20-25(50-29(42)21-17-15-14-16-18-21)24(41)23(40)30(48-20)47-19-22-26(51-32(43)36(2,3)4)27(52-33(44)37(5,6)7)28(53-34(45)38(8,9)10)31(49-22)54-35(46)39(11,12)13/h14-18,20,22-28,30-31,41H,19H2,1-13H3/t20-,22-,23+,24-,25-,26-,27+,28+,30+,31+/m1/s1 |
| InChIKey | KHYXFPLWFVLHCV-JXTDQBNOSA-N |
| Mol Weight | 876.8 g/mol |
| Molecular Formula | C39H57IO14 |
| Exact Mass | 876.279302 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 7AYU0QptzYP |
|---|---|
| Name | [4-O-BENZOYL-2,6-DIDEOXY-2-IODO-ALPHA-L-MANNO-HEXOPYRANOSYL]-(1->6)-1,2,3,4-TETRA-O-PIVALOYL-BETA-D-MANNOPYRANOSIDE |
| Compound Number | 19 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C39H57IO14 |
| InChI | InChI=1S/C39H57IO14/c1-20-25(50-29(42)21-17-15-14-16-18-21)24(41)23(40)30(48-20)47-19-22-26(51-32(43)36(2,3)4)27(52-33(44)37(5,6)7)28(53-34(45)38(8,9)10)31(49-22)54-35(46)39(11,12)13/h14-18,20,22-28,30-31,41H,19H2,1-13H3/t20-,22-,23+,24-,25-,26-,27+,28+,30+,31+/m1/s1 |
| InChIKey | KHYXFPLWFVLHCV-JXTDQBNOSA-N |
| Literature Reference Author | A.KIRSCHNING,M.JESBERGER,A.SCHOENBERGER |
| Literature Reference Citation | ORG.LETTERS,3,3623(2001) |
| Literature Reference DOI | 10.1021/ol016545v |
| Molecular Weight | 876.778 g/mol |
| Solvent | CDCl3 |
| Source File Reference | UWLU33925 |