SpectraBase Compound ID | 8lz4h05AcOw |
---|---|
InChI | InChI=1S/C51H74O8/c1-33(12-10-14-34(2)31-52)13-11-15-36(17-18-37-30-38(54)19-21-42(37)55)46(57)59-45(51(9,58)32-53)23-16-35(3)39-24-28-50(8)41-20-22-43-47(4,5)44(56)26-27-48(43,6)40(41)25-29-49(39,50)7/h13-14,17,19-21,25,30,35,39,43,45,52-55,58H,10-12,15-16,18,22-24,26-29,31-32H2,1-9H3/b33-13+,34-14+,36-17-/t35-,39-,43+,45+,48-,49-,50+,51?/m1/s1 |
InChIKey | XESIYWREAFIQIZ-ASMOJZRWSA-N |
Mol Weight | 815.1 g/mol |
Molecular Formula | C51H74O8 |
Exact Mass | 814.538369 g/mol |
SpectraBase Spectrum ID | 7BZnpqIerZg |
---|---|
Name | GANOSINENSIN_C;GANODERMANONTRIOL_24-O-{(2-Z,5-E,9-E)-2-[2-(2,5-DIHYDROXYPHENYL)-ETHYLIDENE]-11-HYDROXY-6,10-DIMETHYLUNDECA-5,9-DIENATE} |
Compound Number | 3 |
Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
Formula | C51H74O8 |
InChI | InChI=1S/C51H74O8/c1-33(12-10-14-34(2)31-52)13-11-15-36(17-18-37-30-38(54)19-21-42(37)55)46(57)59-45(51(9,58)32-53)23-16-35(3)39-24-28-50(8)41-20-22-43-47(4,5)44(56)26-27-48(43,6)40(41)25-29-49(39,50)7/h13-14,17,19-21,25,30,35,39,43,45,52-55,58H,10-12,15-16,18,22-24,26-29,31-32H2,1-9H3/b33-13+,34-14+,36-17-/t35-,39-,43+,45+,48-,49-,50+,51?/m1/s1 |
InChIKey | XESIYWREAFIQIZ-ASMOJZRWSA-N |
Literature Reference Author | N.SATO,C.M.MA,K.KOMATSU,M.HATTORI |
Literature Reference Citation | J.NAT.PROD.,72,958(2009) |
Literature Reference DOI | 10.1021/np800687t |
Molecular Weight | 815.144 g/mol |
Sample ID | 32630 |
Solvent | CDCl3 |