| SpectraBase Compound ID | zcuTzk6fh3 |
|---|---|
| InChI | InChI=1S/C49H72O16/c1-25(50)32-17-20-49(55)47(32,6)36(63-44(53)29-13-11-10-12-14-29)24-35-46(5)18-16-31(21-30(46)15-19-48(35,49)54)62-37-22-33(56-7)41(27(3)59-37)64-38-23-34(57-8)42(28(4)60-38)65-45-40(52)43(58-9)39(51)26(2)61-45/h10-15,26-28,31-43,45,51-52,54-55H,16-24H2,1-9H3/t26-,27-,28+,31+,32+,33+,34-,35-,36-,37+,38-,39-,40-,41-,42+,43-,45+,46+,47+,48+,49-/m1/s1 |
| InChIKey | RZNAJJMCFUWAQD-QSIVSFGLSA-N |
| Mol Weight | 917.1 g/mol |
| Molecular Formula | C49H72O16 |
| Exact Mass | 916.482036 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 9eLyqaTExCW |
|---|---|
| Name | FOLOTSOSIDE-A;12-O-BENZOYL-LINEOLON-6-DESOXY-3-O-METHYL-BETA-D-ALLOPYRANOSYL-(1->4)-BETA-D-CYMAROPYRANOSYL-(1->4)-BETA-D-CYMAROSIDE |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C49H72O16 |
| InChI | InChI=1S/C49H72O16/c1-25(50)32-17-20-49(55)47(32,6)36(63-44(53)29-13-11-10-12-14-29)24-35-46(5)18-16-31(21-30(46)15-19-48(35,49)54)62-37-22-33(56-7)41(27(3)59-37)64-38-23-34(57-8)42(28(4)60-38)65-45-40(52)43(58-9)39(51)26(2)61-45/h10-15,26-28,31-43,45,51-52,54-55H,16-24H2,1-9H3/t26-,27-,28+,31+,32+,33+,34-,35-,36-,37+,38-,39-,40-,41-,42+,43-,45+,46+,47+,48+,49-/m1/s1 |
| InChIKey | RZNAJJMCFUWAQD-QSIVSFGLSA-N |
| Literature Reference Author | P.RASOANAIVO,N.KANEDA,A.D.KINGHORN,N.R.FARNSWORTH |
| Literature Reference Citation | J.NAT.PROD.,54,1672(1991) |
| Literature Reference DOI | 10.1021/np50078a031 |
| Molecular Weight | 917.101 g/mol |
| Solvent | CDCl3 |
| Source File Reference | UWED18169 |