| SpectraBase Compound ID | 5rOuvToxDlC |
|---|---|
| InChI | InChI=1S/C43H60O22/c1-6-19-22(25(38(54)56-5)15-59-40(19)64-42-36(52)34(50)32(48)28(11-44)62-42)9-30(46)57-14-24-18(4)27-8-21(24)17(3)13-58-39(55)26-16-60-41(20(7-2)23(26)10-31(47)61-27)65-43-37(53)35(51)33(49)29(12-45)63-43/h6-7,15-18,21-24,27-29,32-37,40-45,48-53H,8-14H2,1-5H3/b19-6-,20-7-/t17-,18+,21-,22-,23-,24+,27-,28-,29-,32-,33-,34+,35+,36-,37-,40?,41-,42+,43+/m1/s1 |
| InChIKey | QEHQBLYCUVJSGZ-XSDQTPBMSA-N |
| Mol Weight | 928.9 g/mol |
| Molecular Formula | C43H60O22 |
| Exact Mass | 928.357624 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | AaYxTk6cSb3 |
|---|---|
| Name | JASNUDIFLOSIDE-C |
| Compound Number | 3 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C43H60O22 |
| InChI | InChI=1S/C43H60O22/c1-6-19-22(25(38(54)56-5)15-59-40(19)64-42-36(52)34(50)32(48)28(11-44)62-42)9-30(46)57-14-24-18(4)27-8-21(24)17(3)13-58-39(55)26-16-60-41(20(7-2)23(26)10-31(47)61-27)65-43-37(53)35(51)33(49)29(12-45)63-43/h6-7,15-18,21-24,27-29,32-37,40-45,48-53H,8-14H2,1-5H3/b19-6-,20-7-/t17-,18+,21-,22-,23-,24+,27-,28-,29-,32-,33-,34+,35+,36-,37-,40?,41-,42+,43+/m1/s1 |
| InChIKey | QEHQBLYCUVJSGZ-XSDQTPBMSA-N |
| Literature Reference Author | T.TANAHASHI,Y.TAKENAKA,N.NAGAKURA,T.NISHI |
| Literature Reference Citation | J.NAT.PROD.,62,1311(1999) |
| Literature Reference DOI | 10.1021/np9901175 |
| Molecular Weight | 928.936 g/mol |
| Solvent | CD3OD |
| Source File Reference | UWCS21932 |