| SpectraBase Compound ID | Gre94TaHbMX |
|---|---|
| InChI | InChI=1S/C46H72O17/c1-41(2)14-21-20-8-9-26-43(5)12-11-28(42(3,4)25(43)10-13-44(26,6)45(20,7)15-27(49)46(21)16-29(41)62-40(46)56)61-38-35(55)33(53)32(52)24(60-38)19-59-39-36(31(51)23(48)18-58-39)63-37-34(54)30(50)22(47)17-57-37/h8,21-39,47-55H,9-19H2,1-7H3/t21-,22+,23-,24+,25?,26?,27+,28-,29-,30-,31-,32+,33-,34+,35+,36+,37-,38-,39-,43-,44+,45+,46+/m0/s1 |
| InChIKey | PVLIPPHITNPLBJ-ULNDCBIUSA-N |
| Mol Weight | 897.1 g/mol |
| Molecular Formula | C46H72O17 |
| Exact Mass | 896.476951 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 8I7JSBKJWv2 |
|---|---|
| Name | PROSAPOGENIN-3;3-O-BETA-D-XYLOPYRANOSYL-(1->2)-ALPHA-L-ARABINOPYRANOSYL-(1->6)-BETA-D-GLUCOPYRANOSYL-ACACIC-ACID-LACTONE |
| Compound Number | 6 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C46H72O17 |
| InChI | InChI=1S/C46H72O17/c1-41(2)14-21-20-8-9-26-43(5)12-11-28(42(3,4)25(43)10-13-44(26,6)45(20,7)15-27(49)46(21)16-29(41)62-40(46)56)61-38-35(55)33(53)32(52)24(60-38)19-59-39-36(31(51)23(48)18-58-39)63-37-34(54)30(50)22(47)17-57-37/h8,21-39,47-55H,9-19H2,1-7H3/t21-,22+,23-,24+,25?,26?,27+,28-,29-,30-,31-,32+,33-,34+,35+,36+,37-,38-,39-,43-,44+,45+,46+/m0/s1 |
| InChIKey | PVLIPPHITNPLBJ-ULNDCBIUSA-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 | 897.067 g/mol |
| Solvent | PYRIDINE-D5 |
| Source File Reference | UWCP116 |