SpectraBase Compound ID | KmTqwbHnMzW |
---|---|
InChI | InChI=1S/C44H64O24/c1-6-20-22(25(39(57)59-4)16-62-41(20)67-43-37(55)35(53)33(51)28(13-47)65-43)9-30(49)61-15-24-18(3)8-27(32(24)19(11-45)12-46)64-31(50)10-23-21(7-2)42(63-17-26(23)40(58)60-5)68-44-38(56)36(54)34(52)29(14-48)66-44/h6-7,16-19,22-24,27-29,32-38,41-48,51-56H,8-15H2,1-5H3/b20-6-,21-7+/t18-,22+,23-,24+,27-,28-,29+,32-,33-,34+,35+,36-,37-,38+,41+,42-,43+,44-/m0/s1 |
InChIKey | GRSXDODWOZXZCE-YCKKQMFASA-N |
Mol Weight | 977.0 g/mol |
Molecular Formula | C44H64O24 |
Exact Mass | 976.378753 g/mol |
SpectraBase Spectrum ID | 4HDsxti1zAp |
---|---|
Name | CRAIGOSIDE-B |
Compound Number | 2 |
Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
Formula | C44H64O24 |
InChI | InChI=1S/C44H64O24/c1-6-20-22(25(39(57)59-4)16-62-41(20)67-43-37(55)35(53)33(51)28(13-47)65-43)9-30(49)61-15-24-18(3)8-27(32(24)19(11-45)12-46)64-31(50)10-23-21(7-2)42(63-17-26(23)40(58)60-5)68-44-38(56)36(54)34(52)29(14-48)66-44/h6-7,16-19,22-24,27-29,32-38,41-48,51-56H,8-15H2,1-5H3/b20-6-,21-7+/t18-,22+,23-,24+,27-,28-,29+,32-,33-,34+,35+,36-,37-,38+,41+,42-,43+,44-/m0/s1 |
InChIKey | GRSXDODWOZXZCE-YCKKQMFASA-N |
Literature Reference Author | F.R.GALLO,G.PALAZZINO,E.FEDERICI,R.IURILLI,F.D.MONACHE,K.CHI FUNDERA,C.GALEFFI |
Literature Reference Citation | PHYTOCHEM.,67,504(2006) |
Literature Reference DOI | 10.1016/j.phytochem.2005.11.007 |
Molecular Weight | 976.978 g/mol |
Sample ID | 66099 |
Solvent | CD3OD |