Exact Mass: 216.1393
Exact Mass Matches: 216.1393
Found 169 metabolites which its exact mass value is equals to given mass value 216.1393,
within given mass tolerance error 0.01 dalton. Try search metabolite list with more accurate mass tolerance error
0.001 dalton.
Valylvaline
Valylvaline is a dipeptide composed of two valine residues. It is an incomplete breakdown product of protein digestion or protein catabolism. Dipeptides are organic compounds containing a sequence of exactly two alpha-amino acids joined by a peptide bond. Some dipeptides are known to have physiological or cell-signalling effects although most are simply short-lived intermediates on their way to specific amino acid degradation pathways following further proteolysis. H-VAL-VAL-OH is a dipeptide of the amino acid valine, an essential amino acid[1].
Undecanedioic acid
Undecanedioic acid has been found in parts of human aortas with advanced atherosclerotic lesions associated with intercellular matrix macromolecules and specifically with elastin, and may be the result of an increased hydrolysis of esters and (or) a decreased esterification. (PMID:131675). Undecanedioic acid has been found (among other unusual dicarboxylic acids) in the urine from patients under hopantenate therapy during episodes of Reyes-like syndrome. (PMID:2331533). Undecanedioic acid has been found in parts of human aortas with advanced atherosclerotic lesions associated with intercellular matrix macromolecules and specifically with elastin, and may be the result of an increased hydrolysis of esters and (or) a decreased esterification. (PMID: 131675) Undecanedioic acid is associated with intercellular matrix macromolecules and specifically with elastin.
(R)-2-Amino-N-(2,2,4,4-tetramethyl-3-thietanyl)propanamide
Aqueous degradation production of Alitame
Butyl butyryllactate
Butyl butyryllactate is present in fruits of two Korean strawberry cultivars (Bogyojosaeng and suhong). Butyl butyryllactate is a flavouring ingredient. Present in fruits of two Korean strawberry cultivars (Bogyojosaeng and suhong). Flavouring ingredient.
methyl azelate
A fatty acid methyl ester that is nonanedioic acid in which both carboxy groups are replaced by methoxycarbonyl groups.
2-{[4-(2-Cyanoallyl)piperazino]methyl}acrylonitrile
4alpha-(3,5-dihydroxy-heptyl)-3alpha-methyl-2-oxetanone
(3R*,4S*,5R*)-4,5-dihydro-4-hydroxy-5-(1-hydroxy-2-methylbutyl)-3,5-dimethylfuran-2(3H)-one|xylariolide A
(2R)-2-[(2R,5S)-5-[(2S)-2-hydroxybutyl]oxolan-2-yl]propanoic acid
3-(1-hydroxyhexyl)-5-(hydroxymethyl)oxolan-2-one
5-(hydroxymethyl)-3-(1-hydroxy-4-methylpentyl)oxolan-2-one
UNDECANEDIOIC ACID
An alpha,omega-dicarboxylic acid that is nonane with two carboxylic acid groups at positions C-1 and C-9. Undecanedioic acid is associated with intercellular matrix macromolecules and specifically with elastin.
(2R)-2-[(2R,5S)-5-[(2S)-2-hydroxybutyl]oxolan-2-yl]propanoic acid
5-(hydroxymethyl)-3-(1-hydroxy-4-methylpentyl)oxolan-2-one
(2R)-2-[(2R,5S)-5-[(2S)-2-hydroxybutyl]oxolan-2-yl]propanoic acid [IIN-based on: CCMSLIB00000848005]
(2R)-2-[(2R,5S)-5-[(2S)-2-hydroxybutyl]oxolan-2-yl]propanoic acid [IIN-based: Match]
FA 11:1;O2
CONFIDENCE standard compound; INTERNAL_ID 476; DATASET 20200303_ENTACT_RP_MIX506; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 4427; ORIGINAL_PRECURSOR_SCAN_NO 4423 CONFIDENCE standard compound; INTERNAL_ID 476; DATASET 20200303_ENTACT_RP_MIX506; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 4442; ORIGINAL_PRECURSOR_SCAN_NO 4441 CONFIDENCE standard compound; INTERNAL_ID 476; DATASET 20200303_ENTACT_RP_MIX506; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 4399; ORIGINAL_PRECURSOR_SCAN_NO 4398 CONFIDENCE standard compound; INTERNAL_ID 476; DATASET 20200303_ENTACT_RP_MIX506; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 4432; ORIGINAL_PRECURSOR_SCAN_NO 4430 CONFIDENCE standard compound; INTERNAL_ID 476; DATASET 20200303_ENTACT_RP_MIX506; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 4426; ORIGINAL_PRECURSOR_SCAN_NO 4424 CONFIDENCE standard compound; INTERNAL_ID 476; DATASET 20200303_ENTACT_RP_MIX506; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 4416; ORIGINAL_PRECURSOR_SCAN_NO 4412 Undecanedioic acid is associated with intercellular matrix macromolecules and specifically with elastin.
5-(hydroxymethyl)-3-(1-hydroxy-4-methylpentyl)oxolan-2-one_major
(2R)-2-[(2R,5S)-5-[(2S)-2-hydroxybutyl]oxolan-2-yl]propanoic acid_84.7\\%
(3S,4R)-3-[(1S)-1-hydroxyhexyl]-4-(hydroxymethyl)oxolan-2-one_major
(2R)-2-[(2R,5S)-5-[(2S)-2-hydroxybutyl]oxolan-2-yl]propanoic acid_major
(3S,4R)-3-[(1S)-1-Hydroxyhexyl]-4-(hydroxymethyl)oxolan-2-one
Val-val
A dipeptide formed from two L-valine residues. H-VAL-VAL-OH is a dipeptide of the amino acid valine, an essential amino acid[1].
2-amino-N-(2,2,4,4-tetramethylthietan-3-yl)propanamide
Thiourea,N-(1-cyclopropyl-2-methoxyethyl)-N-propyl-
Propanedioic acid,2-methyl-2-propyl-, 1,3-diethyl ester
1-Piperazinecarboxylicacid, 4-(3-hydroxypropyl)-, ethyl ester
TERT-BUTYL ((3R,5R)-5-(HYDROXYMETHYL)PYRROLIDIN-3-YL)CARBAMATE HYDROCHLORIDE
tert-butyl 3-amino-4-(hydroxymethyl)pyrrolidine-1-carboxylate
Carbamicacid,N-[(3S,5S)-5-(hydroxymethyl)-3-pyrrolidinyl]-,1,1-dimethylethylester
(R)-TERT-BUTYL (1-AMINO-3-METHYL-1-OXOBUTAN-2-YL)CARBAMATE
tert-butyl 3-amino-4-hydroxypiperidine-1-carboxylate
Propanedioic acid,2-(1,1-dimethylethyl)-, 1,3-diethyl ester
tert-Butyl 2-(tetrahydro-2H-pyran-4-yl)hydrazinecarboxylate
2-Amino-5-(4-methylpiperazinyl)benzenecarbonitrile
tert-butyl 3-(aminomethyl)-4-hydroxypyrrolidine-1-carboxylate
3-(tert-Butyl)-1-(pyridin-4-yl)-1H-pyrazol-5-amine
(2S,4S)-1-BOC-2-hydroxyMethyl-4-amino Pyrrolidine-HCl
1-(1H-pyrrolo[2,3-b]pyridin-4-yl)piperidin-4-amine
tert-butyl (2R)-2-(hydroxymethyl)piperazine-1-carboxylate
tert-butyl 2-(hydroxymethyl)piperazine-1-carboxylate
tert-butyl 4-(2-hydroxyethyl)piperazine-1-carboxylate
(2R,4S)-1-BOC-2-HYDROXYMETHYL-4-AMINOPYRROLIDINE HYDROCHLORIDE
3-(4-Piperidinyl)-1H-pyrrolo[2,3-b]pyridin-6-amine
(R)-3-(Aminomethyl)morpholine-4-carboxylic acid tert-butyl ester
TRANS-TERT-BUTYL 3-AMINO-4-METHOXYPYRROLIDINE-1-CARBOXYLATE
2,2-[(2,2-Dimethyl-1,3-propanediyl)bis(oxymethylene)]dioxirane
tert-butyl (3R,5S)-5-(hydroxymethyl)pyrrolidin-3-ylcarbamate
tert-butyl (2S)-2-(hydroxymethyl)piperazine-1-carboxylate
tert-butyl (S)-2-((aminooxy)methyl)pyrrolidine-1-carboxylate
Propanedioic acid,2-methyl-2-(1-methylethyl)-, 1,3-diethyl ester
(2R,4S)-2-Hydroxymethyl-4-Boc-aminopyrrolidine hydrochloride
(3R,4R)-3-[(1S)-1-hydroxy-4-methylpentyl]-4-(hydroxymethyl)oxolan-2-one
(3R,4R)-3-[(1S)-1-Hydroxyhexyl]-4-(hydroxymethyl)oxolan-2-one
(R)-2-Amino-N-(2,2,4,4-tetramethyl-3-thietanyl)propanamide
Butyl butyryllactate
A diester resulting from the formal condensation of the carboxy group of 2-(butanoyloxy)propanoic acid with butan-1-ol.
ethyl 3-methylbutyl butanedioate
A dieter obtained by the forma condensation of the two carboxy groups of succinic acid with ethanol and 3-methylbutanol respectively.
(3r,4s,7s)-4-hydroxy-7-[(2r)-2-hydroxybutyl]-3-methyloxepan-2-one
(3-hydroxybutan-2-yl)[(1e)-3-hydroxyhex-1-en-1-yl-oxo-λ⁵-azanylidene]amine
(2r)-2-{5-[(2s)-2-hydroxybutyl]oxolan-2-yl}propanoic acid
3,4-dihydroxy-2-isopropyl-5-methylcyclohexane-1-carboxylic acid
azoxyalkene
{"Ingredient_id": "HBIN017459","Ingredient_name": "azoxyalkene","Alias": "NA","Ingredient_formula": "C10H20N2O3","Ingredient_Smile": "CCCCC=C[N+](=NC(C)C(CO)O)[O-]","Ingredient_weight": "NA","OB_score": "NA","CAS_id": "NA","SymMap_id": "NA","TCMID_id": "2063","TCMSP_id": "NA","TCM_ID_id": "NA","PubChem_id": "NA","DrugBank_id": "NA"}
