| SpectraBase Compound ID | 8RDTKT3uyXj |
|---|---|
| InChI | InChI=1S/C40H43IO20/c1-16-33(53-17(2)42)35(55-19(4)44)37(57-21(6)46)39(52-16)51-15-29-34(54-18(3)43)36(56-20(5)45)38(58-22(7)47)40(61-29)60-28-14-27-30(32(49)31(28)41)25(48)13-26(59-27)23-9-11-24(50-8)12-10-23/h9-14,16,29,33-40,49H,15H2,1-8H3/t16-,29+,33-,34+,35+,36-,37+,38+,39+,40+/m1/s1 |
| InChIKey | JOLNXVKWPKAUHQ-HUKQAJDQSA-N |
| Mol Weight | 970.7 g/mol |
| Molecular Formula | C40H43IO20 |
| Exact Mass | 970.139239 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 6jqdSH7ANF3 |
|---|---|
| Name | 5-HYDROXY-6-IODOHEXAACETYLLINARIN |
| Compound Number | 8 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C40H43IO20 |
| InChI | InChI=1S/C40H43IO20/c1-16-33(53-17(2)42)35(55-19(4)44)37(57-21(6)46)39(52-16)51-15-29-34(54-18(3)43)36(56-20(5)45)38(58-22(7)47)40(61-29)60-28-14-27-30(32(49)31(28)41)25(48)13-26(59-27)23-9-11-24(50-8)12-10-23/h9-14,16,29,33-40,49H,15H2,1-8H3/t16-,29+,33-,34+,35+,36-,37+,38+,39+,40+/m1/s1 |
| InChIKey | JOLNXVKWPKAUHQ-HUKQAJDQSA-N |
| Literature Reference Author | J.QUINTIN,G.LEWIN |
| Literature Reference Citation | J.NAT.PROD.,67,1624(2004) |
| Literature Reference DOI | 10.1021/np040079b |
| Molecular Weight | 970.674 g/mol |
| Solvent | CDCl3 |
| Source File Reference | UWMZ8159 |