2-(4-Methyl-3-cyclohexen-1-yl)-2-propanyl 6-O-(6-deoxy-α-L-mannopyranosyl)-β-D-glucopyranoside
2-(4-Methyl-3-cyclohexen-1-yl)-2-propanyl 6-O-(6-deoxy-α-L-mannopyranosyl)-β-D-glucopyranoside Structure
Systematic / IUPAC Name: 2-(4-Methyl-3-cyclohexen-1-yl)-2-propanyl 6-O-(6-deoxy-α-L-mannopyranosyl)-β-D-glucopyranoside
ID: Reference7403
Other Names:
β-D-Glucopyranoside, 1-methyl-1-(4-methyl-3-cyclohexen-1-yl)ethyl 6-O-(6-deoxy-α-L-mannopyranosyl)-;
(2S,3R,4S,5S,6R)-2-{[2-(4-methylcyclohex-3-en-1-yl)propan-2-yl]oxy}-6-({[(2R,3R,4R,5R,6S)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxy}methyl)oxane-3,4,5-triol
Formula: C22H38O10
Spectral Data
2-(4-Methyl-3-cyclohexen-1-yl)-2-propanyl 6-O-(6-deoxy-α-L-mannopyranosyl)-β-D-glucopyranoside mass spectral data can be found in a separate interface. The data are manually curated and of the highest quality.
Available MS Data
| Used Instruments | Orbitrap Fusion Lumos with ETD LBP |
| No. of Spectral Trees | 3 |
| No. of Spectra | 2381 |
| Tandem Spectra | MS1, MS2, MS3, MS4, MS5 |
| Ionization Methods | NSI |
| Analyzers | FT |
| Last Modification | 2/15/2018 9:09:55 AM |
Identificators
| InChI | InChI=1S/C22H38O10/c1-10-5-7-12(8-6-10)22(3,4)32-21-19(28)17(26)15(24)13(31-21)9-29-20-18(27)16(25)14(23)11(2)30-20/h5,11-21,23-28H,6-9H2,1-4H3/t11-,12?,13+,14-,15+,16+,17-,18+,19+,20+,21-/m0/s1 |
| InChI Key | JIDXOGPQCVBGSC-BXUICYMCSA-N |
| Canonical SMILES | CC1C(C(C(C(O1)OCC2C(C(C(C(O2)OC(C)(C)C3CCC(=CC3)C)O)O)O)O)O)O |
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| Splash | |
| Other Names |
β-D-Glucopyranoside, 1-methyl-1-(4-methyl-3-cyclohexen-1-yl)ethyl 6-O-(6-deoxy-α-L-mannopyranosyl)-; (2S,3R,4S,5S,6R)-2-{[2-(4-methylcyclohex-3-en-1-yl)propan-2-yl]oxy}-6-({[(2R,3R,4R,5R,6S)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxy}methyl)oxane-3,4,5-triol |