| SpectraBase Compound ID | Lq6HmfowOYa |
|---|---|
| InChI | InChI=1S/C49H62O23/c1-25(2)18-49(48(63)66-23-28-10-15-30(16-11-28)68-46-43(61)40(58)37(55)32(21-51)70-46,72-47-44(62)41(59)38(56)33(71-47)24-65-34(52)17-12-26-6-4-3-5-7-26)19-35(53)64-22-27-8-13-29(14-9-27)67-45-42(60)39(57)36(54)31(20-50)69-45/h3-17,25,31-33,36-47,50-51,54-62H,18-24H2,1-2H3/b17-12+/t31-,32+,33-,36-,37+,38-,39+,40-,41+,42-,43+,44-,45-,46+,47+,49-/m1/s1 |
| InChIKey | VCCBFXCFLIEPOV-CINRJEAISA-N |
| Mol Weight | 1019.0 g/mol |
| Molecular Formula | C49H62O23 |
| Exact Mass | 1018.368188 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 8qQrT9db4Ij |
|---|---|
| Name | GYMNOSIDE_VI |
| Compound Number | 6 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C49H62O23 |
| InChI | InChI=1S/C49H62O23/c1-25(2)18-49(48(63)66-23-28-10-15-30(16-11-28)68-46-43(61)40(58)37(55)32(21-51)70-46,72-47-44(62)41(59)38(56)33(71-47)24-65-34(52)17-12-26-6-4-3-5-7-26)19-35(53)64-22-27-8-13-29(14-9-27)67-45-42(60)39(57)36(54)31(20-50)69-45/h3-17,25,31-33,36-47,50-51,54-62H,18-24H2,1-2H3/b17-12+/t31-,32+,33-,36-,37+,38-,39+,40-,41+,42-,43+,44-,45-,46+,47+,49-/m1/s1 |
| InChIKey | VCCBFXCFLIEPOV-CINRJEAISA-N |
| Literature Reference Author | T.MORIKAWA,H.XIE,H.MATSUDA,M.YOSHIKAWA |
| Literature Reference Citation | J.NAT.PROD.,69,881(2006) |
| Literature Reference DOI | 10.1021/np0581115 |
| Molecular Weight | 1019.017 g/mol |
| Solvent | C5D5N |
| Source File Reference | UWMZ18525 |