| SpectraBase Compound ID | 24zysH2ffzu |
|---|---|
| InChI | InChI=1S/C43H70O14/c1-38(2)17-22-21-9-10-25-40(4)13-12-27(41(5,20-45)24(40)11-14-43(25,7)42(21,6)16-15-39(22,3)26(46)18-38)55-37-34(31(50)30(49)33(56-37)35(52)53-8)57-36-32(51)29(48)28(47)23(19-44)54-36/h9,22-34,36-37,44-51H,10-20H2,1-8H3/t22-,23+,24+,25+,26+,27-,28+,29-,30-,31-,32+,33-,34+,36-,37+,39+,40-,41+,42+,43+/m0/s1 |
| InChIKey | BMLHAAYMHXIWOH-SSCRXYMISA-N |
| Mol Weight | 811.0 g/mol |
| Molecular Formula | C43H70O14 |
| Exact Mass | 810.476557 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 7gg63aPlFyF |
|---|---|
| Name | AZUKISAPONIN-II-METHYLESTER |
| Compound Number | 7 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C43H70O14 |
| InChI | InChI=1S/C43H70O14/c1-38(2)17-22-21-9-10-25-40(4)13-12-27(41(5,20-45)24(40)11-14-43(25,7)42(21,6)16-15-39(22,3)26(46)18-38)55-37-34(31(50)30(49)33(56-37)35(52)53-8)57-36-32(51)29(48)28(47)23(19-44)54-36/h9,22-34,36-37,44-51H,10-20H2,1-8H3/t22-,23+,24+,25+,26+,27-,28+,29-,30-,31-,32+,33-,34+,36-,37+,39+,40-,41+,42+,43+/m0/s1 |
| InChIKey | BMLHAAYMHXIWOH-SSCRXYMISA-N |
| Literature Reference Author | S.SAKAMOTO,S.KOFUJI,M.KUROYANAGI,A.UENO,S.SEKITA |
| Literature Reference Citation | PHYTOCHEM.,31,1773(1992) |
| Literature Reference DOI | 10.1016/0031-9422(92)83145-O |
| Molecular Weight | 811.020 g/mol |
| Solvent | C5D5N |
| Source File Reference | UWVN6032 |