Exact Mass: 188.0837252

Exact Mass Matches: 188.0837252

Found 194 metabolites which its exact mass value is equals to given mass value 188.0837252, within given mass tolerance error 0.01 dalton. Try search metabolite list with more accurate mass tolerance error 0.001 dalton.

3-Butylidene-1(3H)-isobenzofuranone

InChI=1/C12H12O2/c1-2-3-8-11-9-6-4-5-7-10(9)12(13)14-11/h4-8H,2-3H2,1H3/b11-8

C12H12O2 (188.0837252)


(Z)-3-butylidenephthalide is a gamma-lactone that is phthalide substituted by a butylidene group at position 3. Isolated from Ligusticum porteri, it exhibits hypoglycemic activity. It has a role as a metabolite, a hypoglycemic agent and an EC 3.2.1.20 (alpha-glucosidase) inhibitor. It is a member of 2-benzofurans and a gamma-lactone. It is functionally related to a 2-benzofuran-1(3H)-one. Butylidenephthalide is a natural product found in Ligusticum striatum, Angelica sinensis, and other organisms with data available. (Z)-3-Butylidene-1(3H)-isobenzofuranone is found in herbs and spices. (Z)-3-Butylidene-1(3H)-isobenzofuranone is a constituent of Angelica glauca Flavouring ingredient. 3-Butylidene-1(3H)-isobenzofuranone is found in wild celery and lovage. 3-Butylidenephthalide (Butylidenephthalide) is a phthalic anhydride derivative identified in Ligusticum chuanxiong Hort, and has larvicidal activity (LC50 of 1.56 mg/g for Spodoptera litura larvae)[1]. 3-Butylidenephthalide (Butylidenephthalide) is a phthalic anhydride derivative identified in Ligusticum chuanxiong Hort, and has larvicidal activity (LC50 of 1.56 mg/g for Spodoptera litura larvae)[1].

   

cis-2,3-Dihydro-2,3-dihydroxybiphenyl

(1S,2R)-3-phenylcyclohexa-3,5-diene-1,2-diol

C12H12O2 (188.0837252)


   

(3S)-3-Hydroxy-L-enduracididine

(3R)-3-[(4S)-2-iminoimidazolidin-4-yl]-L-serine

C6H12N4O3 (188.0909362)


A non-proteinogenic L-alpha-amino acid that is L-serine substituted at position 3 by a 2-iminoimidazolidin-4-yl group.

   
   

Tabtoxinine-delta-lactam

Tabtoxinine-delta-lactam

C7H12N2O4 (188.07970319999998)


A delta-lactam that is L-pipecolic acid carrying additional hydroxy and aminomethyl substituents at position 5 as well as an oxo substituent at position 6.

   

N-Acetylglutamine

(2S)-2-Acetamido-5-amino-5-oxopentanoic acid

C7H12N2O4 (188.07970319999998)


N-Acetyl-L-glutamine (NAcGln) or N-Acetylglutamine, belongs to the class of organic compounds known as N-acyl-alpha amino acids. N-acyl-alpha amino acids are compounds containing an alpha amino acid which bears an acyl group at its terminal nitrogen atom. N-Acetylglutamine can also be classified as an alpha amino acid or a derivatized alpha amino acid. Technically, N-Acetylglutamine is a biologically available N-terminal capped form of the proteinogenic alpha amino acid L-glutamine. N-acetyl amino acids can be produced either via direct synthesis of specific N-acetyltransferases or via the proteolytic degradation of N-acetylated proteins by specific hydrolases. N-terminal acetylation of proteins is a widespread and highly conserved process in eukaryotes that is involved in protection and stability of proteins (PMID: 16465618). About 85\\\% of all human proteins and 68\\\% of all yeast proteins are acetylated at their N-terminus (PMID: 21750686). Several proteins from prokaryotes and archaea are also modified by N-terminal acetylation. The majority of eukaryotic N-terminal-acetylation reactions occur through N-acetyltransferase enzymes or NAT‚Äôs (PMID: 30054468). These enzymes consist of three main oligomeric complexes NatA, NatB, and NatC, which are composed of at least a unique catalytic subunit and one unique ribosomal anchor. The substrate specificities of different NAT enzymes are mainly determined by the identities of the first two N-terminal residues of the target protein. The human NatA complex co-translationally acetylates N-termini that bear a small amino acid (A, S, T, C, and occasionally V and G) (PMID: 30054468). NatA also exists in a monomeric state and can post-translationally acetylate acidic N-termini residues (D-, E-). NatB and NatC acetylate N-terminal methionine with further specificity determined by the identity of the second amino acid. N-acetylated amino acids, such as N-acetylglutamine can be released by an N-acylpeptide hydrolase from peptides generated by proteolytic degradation (PMID: 16465618). In addition to the NAT enzymes and protein-based acetylation, N-acetylation of free glutamine can also occur. In particular, N-Acetylglutamine can be biosynthesized from L-glutamine and acetyl-CoA by the enzyme glutamine N-acyltransferase (EC 2.3.1.68). Excessive amounts N-acetyl amino acids including N-acetylglutamine (as well as N-acetylglycine, N-acetylserine, N-acetylmethionine, N-acetylglutamate, N-acetylalanine, N-acetylleucine and smaller amounts of N-acetylthreonine, N-acetylisoleucine, and N-acetylvaline) can be detected in the urine with individuals with acylase I deficiency, a genetic disorder (PMID: 16465618). Aminoacylase I is a soluble homodimeric zinc binding enzyme that catalyzes the formation of free aliphatic amino acids from N-acetylated precursors. In humans, Aminoacylase I is encoded by the aminoacylase 1 gene (ACY1) on chromosome 3p21 that consists of 15 exons (OMIM 609924). Individuals with aminoacylase I deficiency will experience convulsions, hearing loss and difficulty feeding (PMID: 16465618). ACY1 can also catalyze the reverse reaction, the synthesis of acetylated amino acids. Many N-acetylamino acids, including N-acetylglutamine are classified as uremic toxins if present in high abundance in the serum or plasma (PMID: 26317986; PMID: 20613759). Uremic toxins are a diverse group of endogenously produced molecules that, if not properly cleared or eliminated by the kidneys, can cause kidney damage, cardiovascular disease and neurological deficits (PMID: 18287557). N-acetylglutamine can be used for parenteral nutrition as a source of glutamine since glutamine is too unstable whereas N-acetylglutamine is very stable. In patients treated with aminoglycosides and/or glycopeptides, an elevation of N-acetylglutamine in urine suggests renal tubular injury. N-Acetylglutamine (GIcNAc) is a modified amino acid (an acetylated analogue of glutamine), a metabolite present in normal human urine. The decomposition products of GIcNAc have been identified by NMR and HPLC-MS as N-acetyl-L-glutamic acid, N-(2,6-dioxo-3-piperidinyl) acetamide, pyroglutamic acid, glutamic acid, and glutamine. GIcNAc is used for parenteral nutrition as a source of glutamine, since glutamine is too unstable, but GIcNAc is very stable. In patients treated with aminoglycosides and/or glycopeptides, elevation GIcNAc in urine suggests renal tubular injury. High amounts of N-acetylated amino acids (i.e.: N-Acetylglutamine) were detected patient with aminoacylase I deficiency (EC 3.5.1.14, a homodimeric zinc-binding metalloenzyme located in the cytosol), a novel inborn error of metabolism. (PMID: 15331932, 11312773, 7952062, 2569664, 16274666) [HMDB] C78272 - Agent Affecting Nervous System > C47795 - CNS Stimulant Aceglutamide (α-N-Acetyl-L-glutamine) is a psychostimulant and nootropic, used to improve memory and concentration[1].

   

Trigoforin

3,4,7-trimethyl-2H-chromen-2-one

C12H12O2 (188.0837252)


Constituent of Trigonella foenum-graecum (fenugreek). Trigoforin is found in herbs and spices and fenugreek. Trigoforin is found in fenugreek. Trigoforin is a constituent of Trigonella foenum-graecum (fenugreek)

   

(E)-3-(2-Methylpropylidene)-1(3H)-isobenzofuranone

(3E)-3-(2-methylpropylidene)-1,3-dihydro-2-benzofuran-1-one

C12H12O2 (188.0837252)


3-(2-methylpropylidene)-1(3h)-isobenzofuranone is a member of the class of compounds known as isobenzofuranones. Isobenzofuranones are compounds containing a 2-benzofuran moiety that carries an oxo group at the 1 position. 3-(2-methylpropylidene)-1(3h)-isobenzofuranone is practically insoluble (in water) and an extremely weak basic (essentially neutral) compound (based on its pKa). 3-(2-methylpropylidene)-1(3h)-isobenzofuranone can be found in wild celery, which makes 3-(2-methylpropylidene)-1(3h)-isobenzofuranone a potential biomarker for the consumption of this food product. (E)-3-(2-Methylpropylidene)-1(3H)-isobenzofuranone is found in green vegetables. (E)-3-(2-Methylpropylidene)-1(3H)-isobenzofuranone is a odorous constituent of celer

   

Glycylhydroxyproline

(2S,4R)-1-(2-aminoacetyl)-4-hydroxypyrrolidine-2-carboxylic acid

C7H12N2O4 (188.07970319999998)


Glycylhydroxyproline is likely a proteolytic breakdown product of collagen. It belongs to the family of peptides. These are compounds containing an amide derived from two or more amino carboxylic acid molecules (the same or different) by the formation of a covalent bond from the carbonyl carbon of one to the nitrogen atom of another. It is found in urine (PMID: 3782411). A dipeptide found in urine (PMID: 3782411). This is a proteolytic breakdown product of collagen. [HMDB]

   

Allyl cinnamate

Prop-2-en-1-yl (2Z)-3-phenylprop-2-enoic acid

C12H12O2 (188.0837252)


Allyl cinnamate is a flavouring agent. Flavouring agent

   

1(3H)-Isobenzofuranone, 3-butylidene-

3-butylidene-1,3-dihydro-2-benzofuran-1-one

C12H12O2 (188.0837252)


   

gamma-Glutamylacetamide

2-Amino-6-(C-hydroxycarbonimidoyl)-5-oxohexanoate

C7H12N2O4 (188.07970319999998)


   

H-Hyp-gly-OH

2-((2S,4R)-4-Hydroxypyrrolidine-2-carboxamido)acetic acid

C7H12N2O4 (188.07970319999998)


   

tetrahydroxybutylimidazole

1-(1H-imidazol-2-yl)butane-1,4,4,4-tetrol

C7H12N2O4 (188.07970319999998)


   

(E)-Butylidene phthalide

(3Z)-3-butylidene-1,3-dihydro-2-benzofuran-1-one

C12H12O2 (188.0837252)


(e)-butylidene phthalide, also known as 3-butylidene-1(3h)-isobenzofuranone, is a member of the class of compounds known as isobenzofuranones. Isobenzofuranones are compounds containing a 2-benzofuran moiety that carries an oxo group at the 1 position (e)-butylidene phthalide is practically insoluble (in water) and an extremely weak basic (essentially neutral) compound (based on its pKa). (e)-butylidene phthalide can be found in wild celery, which makes (e)-butylidene phthalide a potential biomarker for the consumption of this food product. 3-Butylidenephthalide (Butylidenephthalide) is a phthalic anhydride derivative identified in Ligusticum chuanxiong Hort, and has larvicidal activity (LC50 of 1.56 mg/g for Spodoptera litura larvae)[1]. 3-Butylidenephthalide (Butylidenephthalide) is a phthalic anhydride derivative identified in Ligusticum chuanxiong Hort, and has larvicidal activity (LC50 of 1.56 mg/g for Spodoptera litura larvae)[1].

   

(E,E)-2,8-Decadiene-4,6-diyn-1-ol acetate

(E,E)-2,8-Decadiene-4,6-diyn-1-ol acetate

C12H12O2 (188.0837252)


   
   

2-(prop-1-en-2-yl)-2,3-dihydrobenzofuran-5-carbaldehyde

2-(prop-1-en-2-yl)-2,3-dihydrobenzofuran-5-carbaldehyde

C12H12O2 (188.0837252)


   

(E,Z)-2,8-Decadiene-4,6-diyn-1-ol acetate

(E,Z)-2,8-Decadiene-4,6-diyn-1-ol acetate

C12H12O2 (188.0837252)


   

Z-butylidenephthalide

Z-butylidenephthalide

C12H12O2 (188.0837252)


   

5-Phenylcyclohexane-1,3-dione

5-Phenylcyclohexane-1,3-dione

C12H12O2 (188.0837252)


   
   

3-Butylidene-1(3H)-isobenzofuranone

(3E)-3-butylidene-1,3-dihydro-2-benzofuran-1-one

C12H12O2 (188.0837252)


(Z)-3-Butylidene-1(3H)-isobenzofuranone is found in herbs and spices. (Z)-3-Butylidene-1(3H)-isobenzofuranone is a constituent of Angelica glauca Flavouring ingredient. 3-Butylidene-1(3H)-isobenzofuranone is found in wild celery and lovage. 3-Butylidenephthalide (Butylidenephthalide) is a phthalic anhydride derivative identified in Ligusticum chuanxiong Hort, and has larvicidal activity (LC50 of 1.56 mg/g for Spodoptera litura larvae)[1]. 3-Butylidenephthalide (Butylidenephthalide) is a phthalic anhydride derivative identified in Ligusticum chuanxiong Hort, and has larvicidal activity (LC50 of 1.56 mg/g for Spodoptera litura larvae)[1].

   
   

4-hydroxy-5-methoxy-2-methyl-naphthalene

4-hydroxy-5-methoxy-2-methyl-naphthalene

C12H12O2 (188.0837252)


   

1,8-Decadiene-3,6-diyn-5-ol-(Z)-form-Ac|5-acetoxy-deca-1,8Z-diene-3,6-diyne

1,8-Decadiene-3,6-diyn-5-ol-(Z)-form-Ac|5-acetoxy-deca-1,8Z-diene-3,6-diyne

C12H12O2 (188.0837252)


   

METHYL 5-PHENYLPENTA-2,4-DIENOATE

METHYL 5-PHENYLPENTA-2,4-DIENOATE

C12H12O2 (188.0837252)


   

Benzofuran, 5-methoxy-2-(1-methylethenyl)-

Benzofuran, 5-methoxy-2-(1-methylethenyl)-

C12H12O2 (188.0837252)


   

2,2-DIMETHYL-2H-CHROMENE-6-CARBALDEHYDE

2,2-DIMETHYL-2H-CHROMENE-6-CARBALDEHYDE

C12H12O2 (188.0837252)


   

7-ethyl-4-methyl-2H-chromen-2-one

7-ethyl-4-methyl-2H-chromen-2-one

C12H12O2 (188.0837252)


   
   

3-Propyl-1H-2-benzopyran-1-one

3-Propyl-1H-2-benzopyran-1-one

C12H12O2 (188.0837252)


   
   
   
   
   

1-Alcohol-4-Hydroxy-3-(3-methyl-3-buten-1-ynyl)benzoic acid enzoic acid|4-hydroxy-3-(3-methylbut-3-en-1-ynyl)benzyl alcohol|eutypinol

1-Alcohol-4-Hydroxy-3-(3-methyl-3-buten-1-ynyl)benzoic acid enzoic acid|4-hydroxy-3-(3-methylbut-3-en-1-ynyl)benzyl alcohol|eutypinol

C12H12O2 (188.0837252)


   
   

1,8-dimethoxynaphthalene

1,8-dimethoxynaphthalene

C12H12O2 (188.0837252)


   
   

N-Acetyl-glutamine; AIF; CE0; CorrDec

N-Acetyl-glutamine; AIF; CE0; CorrDec

C7H12N2O4 (188.07970319999998)


   

N-Acetyl-glutamine; AIF; CE10; CorrDec

N-Acetyl-glutamine; AIF; CE10; CorrDec

C7H12N2O4 (188.07970319999998)


   

N-Acetyl-glutamine; AIF; CE30; CorrDec

N-Acetyl-glutamine; AIF; CE30; CorrDec

C7H12N2O4 (188.07970319999998)


   

N-Acetyl-glutamine; AIF; CE0; MS2Dec

N-Acetyl-glutamine; AIF; CE0; MS2Dec

C7H12N2O4 (188.07970319999998)


   

N-Acetyl-glutamine; AIF; CE10; MS2Dec

N-Acetyl-glutamine; AIF; CE10; MS2Dec

C7H12N2O4 (188.07970319999998)


   

N-Acetyl-glutamine; AIF; CE30; MS2Dec

N-Acetyl-glutamine; AIF; CE30; MS2Dec

C7H12N2O4 (188.07970319999998)


   
   

Aceglutamide

(2S)-2-Acetamido-5-amino-5-oxopentanoic acid

C7H12N2O4 (188.07970319999998)


C78272 - Agent Affecting Nervous System > C47795 - CNS Stimulant Aceglutamide (α-N-Acetyl-L-glutamine) is a psychostimulant and nootropic, used to improve memory and concentration[1].

   

Glu-hyp

L-glycyl-L-hydroxyproline

C7H12N2O4 (188.07970319999998)


   

5,8,11-dodecatriynoic acid

5,8,11-dodecatriynoic acid

C12H12O2 (188.0837252)


   

Trigoforin

3,4,7-trimethyl-2H-chromen-2-one

C12H12O2 (188.0837252)


   

(E)-3-Isobutylidenephthalide

(3E)-3-(2-methylpropylidene)-1,3-dihydro-2-benzofuran-1-one

C12H12O2 (188.0837252)


   

Allyl cinnamate

prop-2-en-1-yl (2Z)-3-phenylprop-2-enoate

C12H12O2 (188.0837252)


   

FA 12:6

5,8,11-dodecatriynoic acid

C12H12O2 (188.0837252)


   

FOH 12:7;O

(E)-dodeca-2-en-4,6,8-triyne-1,1-diol

C12H12O2 (188.0837252)


   

Tetraethylgermane

Tetraethylgermane

C8H20Ge (188.078572)


   

1,4-Dimethoxynaphthalene

1,4-Dimethoxynaphthalene

C12H12O2 (188.0837252)


   

3-Benzylidene-2,4-pentanedione

3-Benzylidene-2,4-pentanedione

C12H12O2 (188.0837252)


   

2-naphthalen-1-yloxyethanol

2-naphthalen-1-yloxyethanol

C12H12O2 (188.0837252)


   

1,3,5-Triazine-2,4-diamine,6-(4-pyridinyl)-

1,3,5-Triazine-2,4-diamine,6-(4-pyridinyl)-

C8H8N6 (188.08104079999998)


   

[3-(1H-Pyrazol-1-yl)phenyl]boronic acid

[3-(1H-Pyrazol-1-yl)phenyl]boronic acid

C9H9BN2O2 (188.0757044)


   

2,3-Dimethyl-2,3-butanediamine Dihydrochloride

2,3-Dimethyl-2,3-butanediamine Dihydrochloride

C6H18Cl2N2 (188.08469680000002)


   

(L)-2-DIAZOACETYL-PYRROLIDINE-1-CARBOXYLICACIDTERT-BUTYLESTER

(L)-2-DIAZOACETYL-PYRROLIDINE-1-CARBOXYLICACIDTERT-BUTYLESTER

C8H16O3Si (188.0868666)


   

2,2-difluoro-2-(5-methoxypyridin-2-yl)ethanamine

2,2-difluoro-2-(5-methoxypyridin-2-yl)ethanamine

C8H10F2N2O (188.0761154)


   

1-ACETYL-1-BENZOYLCYCLOPROPANE

1-ACETYL-1-BENZOYLCYCLOPROPANE

C12H12O2 (188.0837252)


   
   

1-(2-AMINO-PHENYL)-PIPERIDINE-4-CARBOXYLICACIDETHYLESTER

1-(2-AMINO-PHENYL)-PIPERIDINE-4-CARBOXYLICACIDETHYLESTER

C12H12O2 (188.0837252)


   

5-(phenylmethyl)-3-furanmethanol

5-(phenylmethyl)-3-furanmethanol

C12H12O2 (188.0837252)


   

2-(AMINOMETHYL)-N,N-DIMETHYLPYRIMIDIN-5-AMINE HYDROCHLORIDE

2-(AMINOMETHYL)-N,N-DIMETHYLPYRIMIDIN-5-AMINE HYDROCHLORIDE

C7H13ClN4 (188.0828688)


   

1a,2,3,7b-tetrahydro-1H-cyclopropa[a]naphthalene-1-carboxylic acid

1a,2,3,7b-tetrahydro-1H-cyclopropa[a]naphthalene-1-carboxylic acid

C12H12O2 (188.0837252)


   

Bicyclo[2.2.1]hept-2-yl(chloro)dimethylsilane

Bicyclo[2.2.1]hept-2-yl(chloro)dimethylsilane

C9H17ClSi (188.0787992)


   

Methyl 3-((trimethylsilyl)oxy)-2-butenoate

Methyl 3-((trimethylsilyl)oxy)-2-butenoate

C8H16O3Si (188.0868666)


   

2,2,2-TRIFLUORO-1-PYRIDIN-3-YLETHYLAMINE HYDROCHLORIDE

2,2,2-TRIFLUORO-1-PYRIDIN-3-YLETHYLAMINE HYDROCHLORIDE

C12H12O2 (188.0837252)


   

2,6-Bis(hydroxymethyl)naphthalene

2,6-Bis(hydroxymethyl)naphthalene

C12H12O2 (188.0837252)


   

6-Hydroxy-7-allylindan-1-one

6-Hydroxy-7-allylindan-1-one

C12H12O2 (188.0837252)


   

(2-METHYL-5-PHENYL-3-FURYL)METHANOL

(2-METHYL-5-PHENYL-3-FURYL)METHANOL

C12H12O2 (188.0837252)


   

1,3,5-Triazine-2,4-diamine,6-(3-pyridinyl)-

1,3,5-Triazine-2,4-diamine,6-(3-pyridinyl)-

C8H8N6 (188.08104079999998)


   

2(3H)-Furanone,dihydro-3-methylene-5-(phenylmethyl)-

2(3H)-Furanone,dihydro-3-methylene-5-(phenylmethyl)-

C12H12O2 (188.0837252)


   

(S)-2-Acetamido-5-amino-5-oxopentanoic acid

(S)-2-Acetamido-5-amino-5-oxopentanoic acid

C7H12N2O4 (188.07970319999998)


   

(1-Phenyl-1H-pyrazol-4-yl)boronic acid

(1-Phenyl-1H-pyrazol-4-yl)boronic acid

C9H9BN2O2 (188.0757044)


   
   

methyl 3-(4-ethynylphenyl)propanoate

methyl 3-(4-ethynylphenyl)propanoate

C12H12O2 (188.0837252)


   

(4-(1H-PYRAZOL-1-YL)PHENYL)BORONIC ACID

(4-(1H-PYRAZOL-1-YL)PHENYL)BORONIC ACID

C9H9BN2O2 (188.0757044)


   
   

5-(2-FLUOROPHENYL)-2-PYRIDINAMINE

5-(2-FLUOROPHENYL)-2-PYRIDINAMINE

C11H9FN2 (188.07497259999997)


   

N1,N1-DIETHYLETHANE-1,2-DIAMINE DIHYDROCHLORIDE

N1,N1-DIETHYLETHANE-1,2-DIAMINE DIHYDROCHLORIDE

C6H18Cl2N2 (188.08469680000002)


   

1,8-Naphthalenedimethanol

1,8-Naphthalenedimethanol

C12H12O2 (188.0837252)


   

[2-(1H-Pyrazol-1-yl)phenyl]boronic acid

[2-(1H-Pyrazol-1-yl)phenyl]boronic acid

C9H9BN2O2 (188.0757044)


   

4-Methoxy-1-naphthalenemethanol

4-Methoxy-1-naphthalenemethanol

C12H12O2 (188.0837252)


   

2-Naphthalenemethanol,3-methoxy-

2-Naphthalenemethanol,3-methoxy-

C12H12O2 (188.0837252)


   

Naphthalene,1,5-dimethoxy-

Naphthalene,1,5-dimethoxy-

C12H12O2 (188.0837252)


   

1-(5-Ethyl-1-benzofuran-2-yl)ethan-1-one

1-(5-Ethyl-1-benzofuran-2-yl)ethan-1-one

C12H12O2 (188.0837252)


   

2-HYDROXY-3-PHENYL-CYCLOHEX-2-ENONE

2-HYDROXY-3-PHENYL-CYCLOHEX-2-ENONE

C12H12O2 (188.0837252)


   

[3-(1H-IMIDAZOL-2-YL)PHENYL]BORONICACID

[3-(1H-IMIDAZOL-2-YL)PHENYL]BORONICACID

C9H9BN2O2 (188.0757044)


   

2-(5-FLUORO-PYRIDIN-2-YL)-PHENYLAMINE

2-(5-FLUORO-PYRIDIN-2-YL)-PHENYLAMINE

C11H9FN2 (188.07497259999997)


   

2-methoxy-1-naphthalenemethanol

2-methoxy-1-naphthalenemethanol

C12H12O2 (188.0837252)


   

3-BENZYL-2-HYDROXYCYCLOPENT-2-ENONE

3-BENZYL-2-HYDROXYCYCLOPENT-2-ENONE

C12H12O2 (188.0837252)


   

1-(Methoxymethoxy)naphthalene

1-(Methoxymethoxy)naphthalene

C12H12O2 (188.0837252)


   

2,3-Dimethoxynaphthalene

2,3-Dimethoxynaphthalene

C12H12O2 (188.0837252)


   

(R)-1-(3,5-DIFLUOROPYRIDIN-2-YL)-2-METHOXYETHANAMINE

(R)-1-(3,5-DIFLUOROPYRIDIN-2-YL)-2-METHOXYETHANAMINE

C8H10F2N2O (188.0761154)


   

(5-METHYL-2-PHENYL-3-FURYL)METHANOL

(5-METHYL-2-PHENYL-3-FURYL)METHANOL

C12H12O2 (188.0837252)


   

(5-FLUORO-2-METHOXY-PYRIDIN-3-YL)-METHANOL

(5-FLUORO-2-METHOXY-PYRIDIN-3-YL)-METHANOL

C12H12O2 (188.0837252)


   

(E)-4-(2-(CHLOROPHENYL)ETHENYL-2,6-BIS(1,1-DIMETHYLETHYL)PYRRILIUMSALT

(E)-4-(2-(CHLOROPHENYL)ETHENYL-2,6-BIS(1,1-DIMETHYLETHYL)PYRRILIUMSALT

C8H16O3Si (188.0868666)


   

(4-(1H-IMIDAZOL-2-YL)PHENYL)BORONIC ACID

(4-(1H-IMIDAZOL-2-YL)PHENYL)BORONIC ACID

C9H9BN2O2 (188.0757044)


   

3-Hydroxy-5-phenyl-2-cyclohexen-1-one

3-Hydroxy-5-phenyl-2-cyclohexen-1-one

C12H12O2 (188.0837252)


   

7-Ethoxy-2-naphthalenol

7-Ethoxy-2-naphthalenol

C12H12O2 (188.0837252)


   

1-METHOXY-2-NAPHTHALENEMETHANOL

1-METHOXY-2-NAPHTHALENEMETHANOL

C12H12O2 (188.0837252)


   

Acetamide, 2,2,2-nitrilotris-

Acetamide, 2,2,2-nitrilotris-

C6H12N4O3 (188.0909362)


   

B-[4-(1H-Pyrazol-5-yl)phenyl]-boronic acid

B-[4-(1H-Pyrazol-5-yl)phenyl]-boronic acid

C9H9BN2O2 (188.0757044)


   

CYCLOHEXYL 3-MERCAPTOPROPIONATE

CYCLOHEXYL 3-MERCAPTOPROPIONATE

C9H16O2S (188.0870956)


   

4-amidino-N-nitroso-1-tetrazene-1-carboximidohydrazide

4-amidino-N-nitroso-1-tetrazene-1-carboximidohydrazide

C2H8N10O (188.0882518)


   

Hydrazinecarboxylicacid,1-methylethylester

Hydrazinecarboxylicacid,1-methylethylester

C12H12O2 (188.0837252)


   

(2E)-N-(5-CHLORO-2-METHOXYPHENYL)-2-(HYDROXYIMINO)ACETAMIDE

(2E)-N-(5-CHLORO-2-METHOXYPHENYL)-2-(HYDROXYIMINO)ACETAMIDE

C12H12O2 (188.0837252)


   

formaldehyde, 2-furylmethanol, ure

formaldehyde, 2-furylmethanol, ure

C7H12N2O4 (188.07970319999998)


   

(6-(1H-PYRROL-1-YL)PYRIDIN-3-YL)BORONIC ACID

(6-(1H-PYRROL-1-YL)PYRIDIN-3-YL)BORONIC ACID

C9H9BN2O2 (188.0757044)


   

(6-methoxynaphthalen-2-yl)methanol

(6-methoxynaphthalen-2-yl)methanol

C12H12O2 (188.0837252)


   

1-Cyclopentene-1-carboxylic acid, 4-phenyl- (9CI)

1-Cyclopentene-1-carboxylic acid, 4-phenyl- (9CI)

C12H12O2 (188.0837252)


   

1,6-Dimethoxynaphthalene

1,6-Dimethoxynaphthalene

C12H12O2 (188.0837252)


   

2,7-Dimethoxynaphthalene

2,7-Dimethoxynaphthalene

C12H12O2 (188.0837252)


   

2,6-Dimethoxynaphthalene

2,6-Dimethoxynaphthalene

C12H12O2 (188.0837252)


   

1,2-Dimethoxynaphthalene

1,2-Dimethoxynaphthalene

C12H12O2 (188.0837252)


   

N-dimethylpyrimidin-4-amine hydrochloride

N-dimethylpyrimidin-4-amine hydrochloride

C7H13ClN4 (188.0828688)


   

2-Acetyltetralone

2-Acetyltetralone

C12H12O2 (188.0837252)


   

7-ACETYL-1-TETRALONE

7-ACETYL-1-TETRALONE

C12H12O2 (188.0837252)


   

1,4-NAPHTHALENEDIMETHANOL

1,4-NAPHTHALENEDIMETHANOL

C12H12O2 (188.0837252)


   

2-(4-fluorophenyl)pyridin-4-amine

2-(4-fluorophenyl)pyridin-4-amine

C11H9FN2 (188.07497259999997)


   

4,5,7-TRIMETHYLCOUMARIN

4,5,7-TRIMETHYLCOUMARIN

C12H12O2 (188.0837252)


   

Tetrazene (explosive)

Tetrazene (explosive)

C2H8N10O (188.0882518)


   

[3-(hydroxymethyl)naphthalen-2-yl]methanol

[3-(hydroxymethyl)naphthalen-2-yl]methanol

C12H12O2 (188.0837252)


   

5-(4-fluorophenyl)pyridin-2-amine

5-(4-fluorophenyl)pyridin-2-amine

C11H9FN2 (188.07497259999997)


   

5,7,8-Trimethylcomarin

5,7,8-Trimethylcomarin

C12H12O2 (188.0837252)


   
   

Poly(oxy-1,2-ethanediyl), .alpha.-2-naphthalenyl-.omega.-hydroxy-

Poly(oxy-1,2-ethanediyl), .alpha.-2-naphthalenyl-.omega.-hydroxy-

C12H12O2 (188.0837252)


   

(PYRROLYL-3)-4BUTANOICACID

(PYRROLYL-3)-4BUTANOICACID

C12H12O2 (188.0837252)


   

(Z)-TERT-BUTYL (2-NITROVINYL)CARBAMATE

(Z)-TERT-BUTYL (2-NITROVINYL)CARBAMATE

C7H12N2O4 (188.07970319999998)


   

Naphthalene,1,7-dimethoxy-

Naphthalene,1,7-dimethoxy-

C12H12O2 (188.0837252)


   

3-Acetyl-2-ethylbenzofuran

3-Acetyl-2-ethylbenzofuran

C12H12O2 (188.0837252)


   

[4-(1H-IMIDAZOL-1-YL)PHENYL]BORONIC ACID

[4-(1H-IMIDAZOL-1-YL)PHENYL]BORONIC ACID

C9H9BN2O2 (188.0757044)


   

5-(3-FLUOROPHENYL)-2-PYRIDINAMINE

5-(3-FLUOROPHENYL)-2-PYRIDINAMINE

C11H9FN2 (188.07497259999997)


   

2-fluoro-3-(pyridin-3-ylmethyl)pyridine

2-fluoro-3-(pyridin-3-ylmethyl)pyridine

C11H9FN2 (188.07497259999997)


   

4-(triazol-2-yl)piperidine,hydrochloride

4-(triazol-2-yl)piperidine,hydrochloride

C7H13ClN4 (188.0828688)


   

4-(1H-1,2,4-Triazol-1-yl)piperidinehydrochloride

4-(1H-1,2,4-Triazol-1-yl)piperidinehydrochloride

C7H13ClN4 (188.0828688)


   

2-[(Trimethylsilyl)oxy]ethyl acrylate

2-[(Trimethylsilyl)oxy]ethyl acrylate

C8H16O3Si (188.0868666)


   

(3Z)-5-BROMO-1H-INDOLE-2,3-DIONE3-OXIME

(3Z)-5-BROMO-1H-INDOLE-2,3-DIONE3-OXIME

C10H11F3 (188.08128019999998)


   

6,7,8,9-tetrahydrodibenzofuran-2-ol

6,7,8,9-tetrahydrodibenzofuran-2-ol

C12H12O2 (188.0837252)


   

1-((QUINOLIN-2-YL)METHYL)PIPERIDIN-4-ONE

1-((QUINOLIN-2-YL)METHYL)PIPERIDIN-4-ONE

C8H10F2N2O (188.0761154)


   

N,N-DIMETHYL-1,4-BUTANEDIAMINE DIHYDROCHLORIDE

N,N-DIMETHYL-1,4-BUTANEDIAMINE DIHYDROCHLORIDE

C6H18Cl2N2 (188.08469680000002)


   

6-Allyloxyindan-1-one

6-Allyloxyindan-1-one

C12H12O2 (188.0837252)


   
   

(1R,2S)-3-phenylcyclohexa-3,5-diene-1,2-diol

(1R,2S)-3-phenylcyclohexa-3,5-diene-1,2-diol

C12H12O2 (188.0837252)


   

Butanoic acid, 3-methyl-2-oxo-, trimethylsilyl ester

Butanoic acid, 3-methyl-2-oxo-, trimethylsilyl ester

C8H16O3Si (188.0868666)


   

Pentanoic acid, 4-oxo-, trimethylsilyl ester

Pentanoic acid, 4-oxo-, trimethylsilyl ester

C8H16O3Si (188.0868666)


   

Trimethylsilyl 2-oxopentanoate

Trimethylsilyl 2-oxopentanoate

C8H16O3Si (188.0868666)


   

1a,7a-dimethyl-1H-cyclopropa[b]chromen-7-one

1a,7a-dimethyl-1H-cyclopropa[b]chromen-7-one

C12H12O2 (188.0837252)


   

AI3-37306

1(3H)-Isobenzofuranone, 3-butylidene-, (3E)-

C12H12O2 (188.0837252)


   

AI3-02313

InChI=1\C12H12O2\c1-2-10-14-12(13)9-8-11-6-4-3-5-7-11\h2-9H,1,10H2\b9-8

C12H12O2 (188.0837252)


   

(Z)-Butylidenephthalide

(Z)-3-Butylidenephthalide

C12H12O2 (188.0837252)


(z)-3-butylidene-1(3h)-isobenzofuranone, also known as (Z)-3-butylidenephthalide, is a member of the class of compounds known as isobenzofuranones. Isobenzofuranones are compounds containing a 2-benzofuran moiety that carries an oxo group at the 1 position (z)-3-butylidene-1(3h)-isobenzofuranone is practically insoluble (in water) and an extremely weak basic (essentially neutral) compound (based on its pKa). (z)-3-butylidene-1(3h)-isobenzofuranone can be found in herbs and spices and lovage, which makes (z)-3-butylidene-1(3h)-isobenzofuranone a potential biomarker for the consumption of these food products. 3-Butylidenephthalide (Butylidenephthalide) is a phthalic anhydride derivative identified in Ligusticum chuanxiong Hort, and has larvicidal activity (LC50 of 1.56 mg/g for Spodoptera litura larvae)[1]. 3-Butylidenephthalide (Butylidenephthalide) is a phthalic anhydride derivative identified in Ligusticum chuanxiong Hort, and has larvicidal activity (LC50 of 1.56 mg/g for Spodoptera litura larvae)[1].

   

L-2-aminooctanedioate

L-2-aminooctanedioate

C8H14NO4- (188.0922784)


   

(2S,5S)-5-(aminomethyl)-5-hydroxy-6-oxopiperidine-2-carboxylate

(2S,5S)-5-(aminomethyl)-5-hydroxy-6-oxopiperidine-2-carboxylate

C7H12N2O4 (188.07970319999998)


   

(2S)-2-azaniumyl-4-[(3S)-3-hydroxy-2-oxoazetidin-3-yl]butanoate

(2S)-2-azaniumyl-4-[(3S)-3-hydroxy-2-oxoazetidin-3-yl]butanoate

C7H12N2O4 (188.07970319999998)


   

N-(butyryl)homoserine

N-(butyryl)homoserine

C8H14NO4- (188.0922784)


   

(2S)-2-{[1-(R)-Carboxyethyl]amino}pentanoate

(2S)-2-{[1-(R)-Carboxyethyl]amino}pentanoate

C8H14NO4- (188.0922784)


   

H-Gly-Hyp-OH

(2S,4R)-1-(2-aminoacetyl)-4-hydroxypyrrolidine-2-carboxylic acid

C7H12N2O4 (188.07970319999998)


   

1-(2-Aminoacetyl)-4-hydroxypyrrolidine-2-carboxylic acid

1-(2-Aminoacetyl)-4-hydroxypyrrolidine-2-carboxylic acid

C7H12N2O4 (188.07970319999998)


   
   
   

(2S)-2-[(R)-1-carboxyethylamino]pentanoate

(2S)-2-[(R)-1-carboxyethylamino]pentanoate

C8H14NO4- (188.0922784)


   

9-Anthrylborylene

9-Anthrylborylene

C14H9B (188.0797264)


   
   

N-hexanoyl-(2S)-hydroxyglycine

N-hexanoyl-(2S)-hydroxyglycine

C8H14NO4- (188.0922784)


   

(2S)-2-{[(1R)-1-carboxyethyl]amino}valerate

(2S)-2-{[(1R)-1-carboxyethyl]amino}valerate

C8H14NO4- (188.0922784)


   

Methyl {[(acetylamino)acetyl]amino}acetate

Methyl {[(acetylamino)acetyl]amino}acetate

C7H12N2O4 (188.07970319999998)


   

3,7-Dimethyl-2,3-methanochroman-4-one

3,7-Dimethyl-2,3-methanochroman-4-one

C12H12O2 (188.0837252)


   

10-Amino-7-aza-2-azoniatricyclo[6.3.1.04,12]dodeca-1(11),2,4(12),7,9-pentaen-11-ol

10-Amino-7-aza-2-azoniatricyclo[6.3.1.04,12]dodeca-1(11),2,4(12),7,9-pentaen-11-ol

C10H10N3O+ (188.082383)


   

Ligusticum lactone

InChI=1/C12H12O2/c1-2-3-8-11-9-6-4-5-7-10(9)12(13)14-11/h4-8H,2-3H2,1H3/b11-8

C12H12O2 (188.0837252)


(Z)-3-butylidenephthalide is a gamma-lactone that is phthalide substituted by a butylidene group at position 3. Isolated from Ligusticum porteri, it exhibits hypoglycemic activity. It has a role as a metabolite, a hypoglycemic agent and an EC 3.2.1.20 (alpha-glucosidase) inhibitor. It is a member of 2-benzofurans and a gamma-lactone. It is functionally related to a 2-benzofuran-1(3H)-one. Butylidenephthalide is a natural product found in Ligusticum striatum, Angelica sinensis, and other organisms with data available. A gamma-lactone that is phthalide substituted by a butylidene group at position 3. Isolated from Ligusticum porteri, it exhibits hypoglycemic activity. 3-Butylidenephthalide (Butylidenephthalide) is a phthalic anhydride derivative identified in Ligusticum chuanxiong Hort, and has larvicidal activity (LC50 of 1.56 mg/g for Spodoptera litura larvae)[1]. 3-Butylidenephthalide (Butylidenephthalide) is a phthalic anhydride derivative identified in Ligusticum chuanxiong Hort, and has larvicidal activity (LC50 of 1.56 mg/g for Spodoptera litura larvae)[1].

   

(1S-CIS)-3-PHENYL-3 5-CYCLOHEXADIENE-1

(1S,2R)-3-phenylcyclohexa-3,5-diene-1,2-diol

C12H12O2 (188.0837252)


   

(3R)-3-[(4S)-2-iminoimidazolidin-4-yl]-L-serine

(3R)-3-[(4S)-2-iminoimidazolidin-4-yl]-L-serine

C6H12N4O3 (188.0909362)


   

butylidenephthalide

butylidenephthalide

C12H12O2 (188.0837252)


   

(E)-3-(2-Methylpropylidene)-1(3H)-isobenzofuranone

(E)-3-(2-Methylpropylidene)-1(3H)-isobenzofuranone

C12H12O2 (188.0837252)


   
   

2,6-diaminopimelate(2-)

2,6-diaminopimelate(2-)

C7H12N2O4 (188.07970319999998)


A dicarboxylic acid dianion that is the conjugate base of 2,6-diaminopimelic acid.

   

3-phenylcyclohexa-3,5-diene-1,2-diol

3-phenylcyclohexa-3,5-diene-1,2-diol

C12H12O2 (188.0837252)


   

N(2)-acetyl-D-glutamine

N(2)-acetyl-D-glutamine

C7H12N2O4 (188.07970319999998)


An N(2)-acetylglutamine that has D-configuration.

   
   

N(2)-acetylglutamine

N(2)-acetylglutamine

C7H12N2O4 (188.07970319999998)


A glutamine derivative with an acetyl group bound at the alpha-amino group.

   

N-Acetyl-L-glutamine

N-Acetyl-L-glutamine

C7H12N2O4 (188.07970319999998)


An N(2)-acetylglutamine that has L-configuration.

   

Meso-2,6-diaminopimelate(2-)

Meso-2,6-diaminopimelate(2-)

C7H12N2O4 (188.07970319999998)


The meso-isomer of 2,6-diaminopimelate.

   

Phenylcyclohexadienediol

Phenylcyclohexadienediol

C12H12O2 (188.0837252)


   
   

deca-1,8-dien-3,6-diyn-5-yl acetate

deca-1,8-dien-3,6-diyn-5-yl acetate

C12H12O2 (188.0837252)


   

8-methoxy-3-methylnaphthalen-1-ol

8-methoxy-3-methylnaphthalen-1-ol

C12H12O2 (188.0837252)


   

4-(hydroxymethyl)-2-(3-methylbut-3-en-1-yn-1-yl)phenol

4-(hydroxymethyl)-2-(3-methylbut-3-en-1-yn-1-yl)phenol

C12H12O2 (188.0837252)


   

4-(c-hydroxycarbonimidoyl)-2-[(1-hydroxyethylidene)amino]butanoic acid

4-(c-hydroxycarbonimidoyl)-2-[(1-hydroxyethylidene)amino]butanoic acid

C7H12N2O4 (188.07970319999998)