Metabolite information |
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HMDB ID | HMDB0002928 |
Synonyms |
(2S,3R,4R,5R)-4-{[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)tetrahydro-2H-pyran-2-yl]oxy}hexane-1,2,3,5,6-pentol4-O-a-D-Glucopyranosyl-D-glucitol4-O-alpha-D-Glucopyranosyl-D-glucitol4-O-alpha-delta-Glucopyranosyl-delta-glucitol4-O-α-D-glucopyranosyl-D-glucitolAmalti syrupAmalty MR 100D-4-O-alpha-D-GlucopyranosylglucitolD-MaltitolMalbitMalti MRMaltisorbMaltita-D-GLC-(1->4)-D-GLC-ola-D-GLCP-(1->4)-D-GLC-ola-D-Glucosyl-(1->4)-D-glucitolalpha-D-GLC-(1->4)-D-GLC-olalpha-D-GLCP-(1->4)-D-GLC-olalpha-D-Glucosyl-(1->4)-D-glucitoldelta-4-O-alpha-delta-Glucopyranosylglucitoldelta-Maltitolα-D-GLC-(1->4)-D-GLC-olα-D-GLCP-(1->4)-D-GLC-olα-D-glucosyl-(1->4)-D-glucitol |
Chemical formula | C12H24O11 |
IUPAC name | (2S,3R,4R,5R)-4-{[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}hexane-1,2,3,5,6-pentol |
CAS registry number | 585-88-6 |
Monoisotopic molecular weight | 344.13186161 |
Chemical taxonomy |
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Super class | Lipids and lipid-like molecules |
Class | Fatty Acyls |
Sub class | Fatty acyl glycosides |
Biological properties |
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Pathways (Pathway Details in HMDB) |
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Reference | Country | Specimen | Marker function | Participants (Case) | Participants (Control) | |||||||||
Cancer type | Stage | Number | Gender (M,F) | Age mean (range) (M/F) | Smoking status | Type | Number | Gender (M,F) | Age mean (range) (M/F) | Smoking status | ||||
Wen et al. 2013 | China | plasma | diagnosis | adenocarcinoma | I | 31 | 15, 16 | median: 63 (40-81) | smoker, non-smoker | healthy | 28 | 20, 8 | median: 37 (29-50) | smoker, non-smoker |
Reference | Chromatography | Ion source | Positive/Negative mode | Mass analyzer | Identification level |
Wen et al. 2013 | LC | ESI | – | Q-TOF | MS/MS |
Reference | Data processing software | Database search |
Wen et al. 2013 | MassHunter, Mass Profiler Professional software (Agilent) | NIST 08, HMDB, METLIN, LIPID MAPS |
Reference | Difference method | Mean concentration (case) | Mean concentration (control) | Fold change (case/control) | P-value | FDR | VIP |
Wen et al. 2013 | Mann–Whitney–Wilcoxon test, OPLS-DA | – | – | 61.82 | 4.35e-09 | – | 1.25 |
Reference | Classification method | Cutoff value | AUROC 95%CI | Sensitivity (%) | Specificity (%) | Accuracy (%) |
Wen et al. 2013 | ROC curve analysis | – | 0.93 | – | – | – |