| SpectraBase Compound ID | 1T2tdnTM6JB |
|---|---|
| InChI | InChI=1S/C35H56O9/c1-30(2)15-20-19-7-8-23-31(3)11-10-25(44-28-27(40)26(39)21(37)17-43-28)32(4,18-36)22(31)9-12-34(23,6)33(19,5)13-14-35(20,29(41)42)24(38)16-30/h7,20-28,36-40H,8-18H2,1-6H3,(H,41,42)/t20-,21-,22?,23?,24-,25-,26-,27+,28-,31-,32-,33+,34+,35-/m0/s1 |
| InChIKey | YRJUPRDNRGIERZ-NAITXEHMSA-N |
| Mol Weight | 620.8 g/mol |
| Molecular Formula | C35H56O9 |
| Exact Mass | 620.392433 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 7Z17hYXDEOI |
|---|---|
| Name | KALOPANAX-SAPONIN-LA;3-O-ALPHA-L-ARABINOPYRANOSYL-22-ALPHA-HYDROXY-HEDERAGENIN |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C35H56O9 |
| InChI | InChI=1S/C35H56O9/c1-30(2)15-20-19-7-8-23-31(3)11-10-25(44-28-27(40)26(39)21(37)17-43-28)32(4,18-36)22(31)9-12-34(23,6)33(19,5)13-14-35(20,29(41)42)24(38)16-30/h7,20-28,36-40H,8-18H2,1-6H3,(H,41,42)/t20-,21-,22?,23?,24-,25-,26-,27+,28-,31-,32-,33+,34+,35-/m0/s1 |
| InChIKey | YRJUPRDNRGIERZ-NAITXEHMSA-N |
| Literature Reference Author | B.S.JOSHI,K.M.MOORE,S.W.PELLETIER,M.S.PUAR,B.N.PRAMANIK |
| Literature Reference Citation | J.NAT.PROD.,55,1468(1992) |
| Literature Reference DOI | 10.1021/np50088a013 |
| Molecular Weight | 620.824 g/mol |
| Solvent | PYRIDINE-D5 |
| Source File Reference | UWCS5626 |