| SpectraBase Compound ID | LnbiFmoXgX0 |
|---|---|
| InChI | InChI=1S/C47H76O18/c1-20-30(51)34(55)37(65-38-35(56)31(52)23(48)18-60-38)40(62-20)61-19-24-32(53)33(54)36(57)39(63-24)64-29-12-13-44(6)25(43(29,4)5)11-14-45(7)26(44)10-9-21-22-15-42(2,3)27(49)17-47(22,41(58)59)28(50)16-46(21,45)8/h9,20,22-40,48-57H,10-19H2,1-8H3,(H,58,59)/t20-,22+,23-,24-,25?,26?,27+,28-,29+,30+,31+,32-,33+,34+,35-,36-,37-,38+,39+,40-,44+,45-,46-,47-/m1/s1 |
| InChIKey | DIIKKDUOSDFLTB-IPWRCCLOSA-N |
| Mol Weight | 929.1 g/mol |
| Molecular Formula | C47H76O18 |
| Exact Mass | 928.503166 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | LXfG9jjLyaH |
|---|---|
| Name | PROSAPOGENIN-1;3-O-BETA-D-XYLOPYRANOSYL-(1->2)-BETA-D-FUCOPYRANOSYL-(1->6)-BETA-D-GLUCOPYRANOSYL-ACACIC-ACID |
| Compound Number | 4 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C47H76O18 |
| InChI | InChI=1S/C47H76O18/c1-20-30(51)34(55)37(65-38-35(56)31(52)23(48)18-60-38)40(62-20)61-19-24-32(53)33(54)36(57)39(63-24)64-29-12-13-44(6)25(43(29,4)5)11-14-45(7)26(44)10-9-21-22-15-42(2,3)27(49)17-47(22,41(58)59)28(50)16-46(21,45)8/h9,20,22-40,48-57H,10-19H2,1-8H3,(H,58,59)/t20-,22+,23-,24-,25?,26?,27+,28-,29+,30+,31+,32-,33+,34+,35-,36-,37-,38+,39+,40-,44+,45-,46-,47-/m1/s1 |
| InChIKey | DIIKKDUOSDFLTB-IPWRCCLOSA-N |
| Literature Reference Author | T.IKEDA,S.FUJIWARA,K.ARAKI,J.KINJO,T.NOHARA,T.MIYOSHI |
| Literature Reference Citation | J.NAT.PROD.,60,102(1997) |
| Literature Reference DOI | 10.1021/np960556t |
| Molecular Weight | 929.110 g/mol |
| Solvent | PYRIDINE-D5 |
| Source File Reference | UWCP114 |