| SpectraBase Compound ID | J1KZKCB7jp4 |
|---|---|
| InChI | InChI=1S/C46H68O14/c1-24-36(58-27(4)49)37(59-28(5)50)38(60-29(6)51)39(55-24)54-23-43(9)32-15-16-45(11)33(46(32,12)35(57-26(3)48)21-34(43)56-25(2)47)14-13-30-31-22-42(8,40(52)53)18-17-41(31,7)19-20-44(30,45)10/h13,24,31-39H,14-23H2,1-12H3,(H,52,53)/t24-,31-,32?,33?,34-,35-,36-,37+,38+,39+,41+,42+,43-,44+,45+,46+/m0/s1 |
| InChIKey | JZPHXFFQLILBKC-RAFAKFIVSA-N |
| Mol Weight | 845.0 g/mol |
| Molecular Formula | C46H68O14 |
| Exact Mass | 844.460907 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | E3sh0eYBUBK |
|---|---|
| Name | 23-HYDROXYIMBERBIC-ACID-23-O-ALPHA-L-4-ACETYLRHAMNOPYRANOSIDE-PERACETATE |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C46H68O14 |
| InChI | InChI=1S/C46H68O14/c1-24-36(58-27(4)49)37(59-28(5)50)38(60-29(6)51)39(55-24)54-23-43(9)32-15-16-45(11)33(46(32,12)35(57-26(3)48)21-34(43)56-25(2)47)14-13-30-31-22-42(8,40(52)53)18-17-41(31,7)19-20-44(30,45)10/h13,24,31-39H,14-23H2,1-12H3,(H,52,53)/t24-,31-,32?,33?,34-,35-,36-,37+,38+,39+,41+,42+,43-,44+,45+,46+/m0/s1 |
| InChIKey | JZPHXFFQLILBKC-RAFAKFIVSA-N |
| Literature Reference Author | C.B.ROGERS |
| Literature Reference Citation | J.NAT.PROD.,52,528(1989) |
| Literature Reference DOI | 10.1021/np50063a011 |
| Molecular Weight | 845.038 g/mol |
| Solvent | CDCl3 |
| Source File Reference | UWTS1254 |