| SpectraBase Compound ID | HFixqXpsZxd |
|---|---|
| InChI | InChI=1S/C42H50O15/c1-21(2)42(57-37(49)29-18-14-11-15-19-29)32(47)23(4)40(50)30-20-22(3)33(52-24(5)43)41(30,51)38(55-27(8)46)39(9,56-36(48)28-16-12-10-13-17-28)34(53-25(6)44)31(40)35(42)54-26(7)45/h10-19,22-23,30-35,38,47,50-51H,1,20H2,2-9H3/t22-,23+,30-,31-,32-,33-,34-,35+,38+,39+,40-,41+,42-/m0/s1 |
| InChIKey | BHWJAJREPXENPW-GUDQYKIVSA-N |
| Mol Weight | 794.8 g/mol |
| Molecular Formula | C42H50O15 |
| Exact Mass | 794.314971 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | ApcK9m9aakQ |
|---|---|
| Name | TRIGOHOWNIN_G |
| Compound Number | 7 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C42H50O15 |
| InChI | InChI=1S/C42H50O15/c1-21(2)42(57-37(49)29-18-14-11-15-19-29)32(47)23(4)40(50)30-20-22(3)33(52-24(5)43)41(30,51)38(55-27(8)46)39(9,56-36(48)28-16-12-10-13-17-28)34(53-25(6)44)31(40)35(42)54-26(7)45/h10-19,22-23,30-35,38,47,50-51H,1,20H2,2-9H3/t22-,23+,30-,31-,32-,33-,34-,35+,38+,39+,40-,41+,42-/m0/s1 |
| InChIKey | BHWJAJREPXENPW-GUDQYKIVSA-N |
| Literature Reference Author | S.H.DONG,C.R.ZHANG,C.H.XU,J.DING,J.M.YUE |
| Literature Reference Citation | J.NAT.PROD.,74,1255(2011) |
| Literature Reference DOI | 10.1021/np200231u |
| Molecular Weight | 794.850 g/mol |
| Sample ID | 38327 |
| Solvent | CDCl3 |