Systematic / IUPAC Name: 1-O-(1,3,23,24,25-Pentahydroxy-28-oxo-9,19-cyclolanostan-28-yl)hexopyranose
ID: Reference8248
Other Names: Hexopyranose, 1-O-(1,3,23,24,25-pentahydroxy-28-oxo-9,19-cyclolanostan-28-yl)-
Formula: C36H60O12
1-O-(1,3,23,24,25-Pentahydroxy-28-oxo-9,19-cyclolanostan-28-yl)hexopyranose mass spectral data can be found in a separate interface. The data are manually curated and of the highest quality.
Used Instruments | Orbitrap Fusion Lumos with ETD LBP FAIMS |
No. of Spectral Trees | 4 |
No. of Spectra | 5501 |
Tandem Spectra | MS1, MS2, MS3, MS4 |
Ionization Methods | NSI |
Analyzers | FT |
Last Modification | 10/16/2018 8:27:18 AM |
InChI | InChI=1S/C36H60O12/c1-17(13-19(38)28(44)31(2,3)46)18-9-10-33(5)21-7-8-22-34(6,30(45)48-29-27(43)26(42)25(41)20(15-37)47-29)23(39)14-24(40)36(22)16-35(21,36)12-11-32(18,33)4/h17-29,37-44,46H,7-16H2,1-6H3 |
InChI Key | RCCBGOMNZWYBTJ-UHFFFAOYSA-N |
Canonical SMILES | CC(CC(C(C(C)(C)O)O)O)C1CCC2(C1(CCC34C2CCC5C3(C4)C(CC(C5(C)C(=O)OC6C(C(C(C(O6)CO)O)O)O)O)O)C)C |
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Other Names | Hexopyranose, 1-O-(1,3,23,24,25-pentahydroxy-28-oxo-9,19-cyclolanostan-28-yl)- |