| SpectraBase Compound ID | 3FdI8xC5uGX |
|---|---|
| InChI | InChI=1S/C48H82O20/c1-20-30(54)33(57)35(59)40(62-20)67-38-37(66-41-36(60)34(58)31(55)24(17-49)63-41)32(56)25(18-50)64-42(38)65-28-11-12-44(4)26(45(28,5)19-51)10-14-46(6)27(44)15-22(52)29-21(9-13-47(29,46)7)48(8)16-23(53)39(68-48)43(2,3)61/h20-42,49-61H,9-19H2,1-8H3/t20-,21-,22+,23+,24-,25-,26?,27?,28-,29?,30-,31-,32-,33+,34+,35+,36-,37+,38-,39-,40-,41+,42+,44-,45-,46+,47+,48+/m0/s1 |
| InChIKey | VTEPOUWBLYBPKC-PDMAEZIWSA-N |
| Mol Weight | 979.2 g/mol |
| Molecular Formula | C48H82O20 |
| Exact Mass | 978.539945 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | BNR5N3slSKR |
|---|---|
| Name | NEOALSOSIDE-C2 |
| Compound Number | 15 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C48H82O20 |
| InChI | InChI=1S/C48H82O20/c1-20-30(54)33(57)35(59)40(62-20)67-38-37(66-41-36(60)34(58)31(55)24(17-49)63-41)32(56)25(18-50)64-42(38)65-28-11-12-44(4)26(45(28,5)19-51)10-14-46(6)27(44)15-22(52)29-21(9-13-47(29,46)7)48(8)16-23(53)39(68-48)43(2,3)61/h20-42,49-61H,9-19H2,1-8H3/t20-,21-,22+,23+,24-,25-,26?,27?,28-,29?,30-,31-,32-,33+,34+,35+,36-,37+,38-,39-,40-,41+,42+,44-,45-,46+,47+,48+/m0/s1 |
| InChIKey | VTEPOUWBLYBPKC-PDMAEZIWSA-N |
| Literature Reference Author | S.FUJITA,R.KASAI,K.OHTANI,K.YAMASAKI,M.H.CHIU,R.L.NIE,O.TANA KA |
| Literature Reference Citation | PHYTOCHEM.,38,465(1995) |
| Literature Reference DOI | 10.1016/0031-9422(94)00608-V |
| Molecular Weight | 979.167 g/mol |
| Solvent | C5D5N |
| Source File Reference | UWMS4794 |