SpectraBase Compound ID | 5UY6lAsDQfe |
---|---|
InChI | InChI=1S/C45H76O19/c1-19(17-58-40-37(54)34(51)31(48)27(15-46)61-40)7-12-45(57)20(2)30-26(64-45)14-25-23-6-5-21-13-22(8-10-43(21,3)24(23)9-11-44(25,30)4)60-42-39(56)36(53)33(50)29(63-42)18-59-41-38(55)35(52)32(49)28(16-47)62-41/h19-42,46-57H,5-18H2,1-4H3/t19-,20-,21-,22-,23+,24-,25-,26-,27-,28+,29+,30-,31-,32+,33+,34+,35-,36-,37-,38+,39+,40-,41+,42+,43-,44-,45+/m0/s1 |
InChIKey | XDJRIVOSNYPOEY-KMAQWHFVSA-N |
Mol Weight | 921.1 g/mol |
Molecular Formula | C45H76O19 |
Exact Mass | 920.49808 g/mol |
SpectraBase Spectrum ID | Ll7TGCG5E08 |
---|---|
Name | XDJRIVOSNYPOEY-KMAQWHFVSA-N |
Compound Number | 1 |
Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
Formula | C45H76O19 |
InChI | InChI=1S/C45H76O19/c1-19(17-58-40-37(54)34(51)31(48)27(15-46)61-40)7-12-45(57)20(2)30-26(64-45)14-25-23-6-5-21-13-22(8-10-43(21,3)24(23)9-11-44(25,30)4)60-42-39(56)36(53)33(50)29(63-42)18-59-41-38(55)35(52)32(49)28(16-47)62-41/h19-42,46-57H,5-18H2,1-4H3/t19-,20-,21-,22-,23+,24-,25-,26-,27-,28+,29+,30-,31-,32+,33+,34+,35-,36-,37-,38+,39+,40-,41+,42+,43-,44-,45+/m0/s1 |
InChIKey | XDJRIVOSNYPOEY-KMAQWHFVSA-N |
Literature Reference Author | V.L.CHALLINOR,S.PIACENTE,J.J.DEVOSS |
Literature Reference Citation | STEROIDS,77,602(2012) |
Literature Reference DOI | 10.1016/j.steroids.2012.02.002 |
Molecular Weight | 921.087 g/mol |
Sample ID | 968849 |
Solvent | CD3OD |