Exact Mass: 244.1675

Exact Mass Matches: 244.1675

Found 166 metabolites which its exact mass value is equals to given mass value 244.1675, within given mass tolerance error 0.01 dalton. Try search metabolite list with more accurate mass tolerance error 0.001 dalton.

Anagyrine

7,14-Methano-4H,6H-dipyrido(1,2-a:1,2-e)(1,5)diazocin-4-one, 7,7a,8,9,10,11,13,14-octahydro-, (7R-(7alpha,7aalpha,14alpha))-

C15H20N2O (244.1576)


Anagyrine is an alkaloid. Anagyrine is a natural product found in Daphniphyllum oldhamii, Ormosia fordiana, and other organisms with data available. Thermospine is a natural product found in Platycelyphium voense, Thermopsis mongolica, and other organisms with data available. Thermopsine is a quinolizidine alkaloid isolated from the fruits and pods and stem bark of Sophora velutina subsp. Thermopsine has antibacterial activity[1].

   

Sophoramine

(1S,9S,17S)-7,13-diazatetracyclo[7.7.1.0?,?.0??,??]heptadeca-2,4-dien-6-one

C15H20N2O (244.1576)


Sophoramine is a naphthyridine derivative. Sophoramine is a natural product found in Sophora viciifolia, Sophora pachycarpa, and other organisms with data available.

   

verruculotoxin

verruculotoxin

C15H20N2O (244.1576)


   

Rhombifoline

(1R,5S)-3-(But-3-en-1-yl)-3,4,5,6-tetrahydro-1H-1,5-methanopyrido[1,2-a][1,5]diazocin-8(2H)-one

C15H20N2O (244.1576)


Rhombifoline is a natural product found in Plagiocarpus axillaris, Cristonia biloba, and other organisms with data available. Rhombifoline is an alkaloid isolated for the first time from the leaves and stems of A. foetida L.[1]. Rhombifoline is an alkaloid isolated for the first time from the leaves and stems of A. foetida L.[1].

   
   

Tsukushinamine A

Tsukushinamine A

C15H20N2O (244.1576)


   

Thermopsine

(-)-Thermopsine

C15H20N2O (244.1576)


relative retention time with respect to 9-anthracene Carboxylic Acid is 0.155 relative retention time with respect to 9-anthracene Carboxylic Acid is 0.144 Thermopsine is a quinolizidine alkaloid isolated from the fruits and pods and stem bark of Sophora velutina subsp. Thermopsine has antibacterial activity[1].

   

1,11-Undecanedicarboxylic acid

Tridecanedioic acid, monosodium salt

C13H24O4 (244.1675)


1,11-Undecanedicarboxylic acid, also known as 1,13-tridecanedioic acid or brassilic acid, belongs to the class of organic compounds known as long-chain fatty acids. These are fatty acids with an aliphatic tail that contains between 13 and 21 carbon atoms. 1,11-Undecanedicarboxylic acid is a very hydrophobic molecule, practically insoluble in water, and relatively neutral. Undecanedicarboxylic acid is an unusual odd-numbered dicarboxylic acid that appears in the urines of children with neonatal adrenoleukodystrophy and Zellweger syndrome, as an additional marker of these peroxisomal disorders. (PMID: 2943344) [HMDB] Tridecanedioic acid is an endogenous metabolite.

   

Menthyl ethylene glycol carbonate

2-[({[5-methyl-2-(propan-2-yl)cyclohexyl]oxy}carbonyl)oxy]ethan-1-ol

C13H24O4 (244.1675)


Menthyl ethylene glycol carbonate is a physiological cooling agent used in foods. Strong mint flavorant used in chewing gu Physiol. cooling agent used in foods. Strong mint flavorant used in chewing gum

   

(±)-1,4-Nonanediol diacetate

1-(Acetyloxy)nonan-4-yl acetic acid

C13H24O4 (244.1675)


(±)-1,4-Nonanediol diacetate is a flavouring ingredient. Flavouring ingredient

   

(1R,9S,10S)-7,15-Diazatetracyclo[7.7.1.02,7.010,15]heptadeca-2,4-dien-6-one

(1R,9S,10S)-7,15-Diazatetracyclo[7.7.1.02,7.010,15]heptadeca-2,4-dien-6-one

C15H20N2O (244.1576)


   

Dimethyl (3,3-diethylbutyl)malonate

1,3-dimethyl 2-(3-ethyl-3-methylpentyl)propanedioate

C13H24O4 (244.1675)


   

Sophoramine

7,13-diazatetracyclo[7.7.1.0²,⁷.0¹³,¹⁷]heptadeca-2,4-dien-6-one

C15H20N2O (244.1576)


   

SCHEMBL16431431

SCHEMBL16431431

C13H24O4 (244.1675)


   

Sphaeric acid

(+)-Sphaeric acid

C13H24O4 (244.1675)


   

Sarmentoic acid

(-)-Sarmentoic acid

C13H24O4 (244.1675)


   

5,6-Dehydromultiflorine

5,6-Dehydromultiflorine

C15H20N2O (244.1576)


   

Madugin

2,5-bis(3-indolylmethyl)pyrazine

C15H20N2O (244.1576)


   

Tsukushinamin

Tsukushinamin

C15H20N2O (244.1576)


   

SCHEMBL17866984

SCHEMBL17866984

C13H24O4 (244.1675)


   

Megastigm-7-ene-3,5,6,9-tetraol

(1R,2R,4S)-1-[(E,3R)-3-Hydroxybut-1-enyl]-2,6,6-trimethylcyclohexane-1,2,4-triol

C13H24O4 (244.1675)


Megastigm-7-ene-3,5,6,9-tetraol is a natural product found in Cestrum parqui with data available.

   

methyl 3R-hydroxy-11-ketododecanoate

methyl 3R-hydroxy-11-ketododecanoate

C13H24O4 (244.1675)


   

SCHEMBL5929829

SCHEMBL5929829

C13H24O4 (244.1675)


   

Dimethyl undecanedioate

Undecanedioic acid,1,11-dimethyl ester

C13H24O4 (244.1675)


   

(1R,2S,4S)-2-(1-Hydroxy-6-methylheptyl)-4-hydroxymethylbutanolide|Dihydro-5-(hydroxymethyl)-3-(1-hydroxy)-2(3H)-furanone

(1R,2S,4S)-2-(1-Hydroxy-6-methylheptyl)-4-hydroxymethylbutanolide|Dihydro-5-(hydroxymethyl)-3-(1-hydroxy)-2(3H)-furanone

C13H24O4 (244.1675)


   

3,5,6-trihydroxydehydro-alpha-ionol

3,5,6-trihydroxydehydro-alpha-ionol

C13H24O4 (244.1675)


   

tryptamine isovalerate

tryptamine isovalerate

C15H20N2O (244.1576)


   

CHEMBL1797820

CHEMBL1797820

C15H20N2O (244.1576)


   

Megastigm-7-ene-3,4,6,9-tetrol

Megastigm-7-ene-3,4,6,9-tetrol

C13H24O4 (244.1675)


   
   

casuarinine H

casuarinine H

C15H20N2O (244.1576)


   

(-)-tsukushinamine C|Tsukushinamine C

(-)-tsukushinamine C|Tsukushinamine C

C15H20N2O (244.1576)


   
   

12-methoxy-12-oxododecanoic acid

12-methoxy-12-oxododecanoic acid

C13H24O4 (244.1675)


   

SCHEMBL18595162

SCHEMBL18595162

C15H20N2O (244.1576)


   

(1S,9S)-11-but-3-enyl-7,11-diazatricyclo[7.3.1.0<2,7>]trideca-2,4-dien-6-one

(1S,9S)-11-but-3-enyl-7,11-diazatricyclo[7.3.1.0<2,7>]trideca-2,4-dien-6-one

C15H20N2O (244.1576)


relative retention time with respect to 9-anthracene Carboxylic Acid is 0.234 relative retention time with respect to 9-anthracene Carboxylic Acid is 0.232

   

C15H20N2O_2H-Pyrido[1,2-a]pyrazin-1(6H)-one, hexahydro-3-(phenylmethyl)-, (3S,9aS)

NCGC00384659-01_C15H20N2O_2H-Pyrido[1,2-a]pyrazin-1(6H)-one, hexahydro-3-(phenylmethyl)-, (3S,9aS)-

C15H20N2O (244.1576)


   

TRIDECANEDIOIC ACID

1,11-Undecanedicarboxylic acid

C13H24O4 (244.1675)


An alpha,omega-dicarboxylic acid that is undecane substituted by carboxylic acid groups at positions C-1 and C-11. Tridecanedioic acid is an endogenous metabolite.

   

Sophoramine

(5β)-11,12,13,14-Tetradehydromatridin-15-one

C15H20N2O (244.1576)


Origin: Plant; SubCategory_DNP: Alkaloids derived from lysine, Quinolizidine alkaloids, Sophora alkaloid

   

Brassylic acid

TRIDECANEDIOIC ACID

C13H24O4 (244.1675)


CONFIDENCE standard compound; INTERNAL_ID 426; DATASET 20200303_ENTACT_RP_MIX505; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 5003; ORIGINAL_PRECURSOR_SCAN_NO 5002 CONFIDENCE standard compound; INTERNAL_ID 426; DATASET 20200303_ENTACT_RP_MIX505; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 5063; ORIGINAL_PRECURSOR_SCAN_NO 5062 CONFIDENCE standard compound; INTERNAL_ID 426; DATASET 20200303_ENTACT_RP_MIX505; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 5052; ORIGINAL_PRECURSOR_SCAN_NO 5051 CONFIDENCE standard compound; INTERNAL_ID 426; DATASET 20200303_ENTACT_RP_MIX505; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 5103; ORIGINAL_PRECURSOR_SCAN_NO 5099 CONFIDENCE standard compound; INTERNAL_ID 426; DATASET 20200303_ENTACT_RP_MIX505; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 5016; ORIGINAL_PRECURSOR_SCAN_NO 5015 Tridecanedioic acid is an endogenous metabolite.

   

Thermopsine_major

Thermopsine_major

C15H20N2O (244.1576)


   

Brassilate

Undecane-1,11-dicarboxylic acid

C13H24O4 (244.1675)


Tridecanedioic acid is an endogenous metabolite.

   

2-methyl-dodecanedioic acid

2-methyl-dodecanedioic acid

C13H24O4 (244.1675)


   

3-methyl-dodecanedioic acid

3-methyl-dodecanedioic acid

C13H24O4 (244.1675)


   

4-methyl-dodecanedioic acid

4-methyl-dodecanedioic acid

C13H24O4 (244.1675)


   

6-methyl-dodecanedioic acid

6-methyl-dodecanedioic acid

C13H24O4 (244.1675)


   

Anc 1

2-[({[5-methyl-2-(propan-2-yl)cyclohexyl]oxy}carbonyl)oxy]ethan-1-ol

C13H24O4 (244.1675)


   

1,4-Nonadiol diacetate

(±)-1,4-Nonanediol diacetate

C13H24O4 (244.1675)


   

Cladosporester A

Methyl 5,11-dihydroxy-2E-dodecenoate

C13H24O4 (244.1675)


   

Cladosporester B

Methyl 4,11-dihydroxy-2E-dodecenoate

C13H24O4 (244.1675)


   

FA 13:1;O2

6-methyl-dodecanedioic acid

C13H24O4 (244.1675)


   

Dodecanedioic acid monomethyl ester

Dodecanedioic acid monomethyl ester

C13H24O4 (244.1675)


   

2-(3-CYCLOPROPYLPHENYL)-4,4,5,5-TETRAMETHYL-[1,3,2]DIOXABOROLANE

2-(3-CYCLOPROPYLPHENYL)-4,4,5,5-TETRAMETHYL-[1,3,2]DIOXABOROLANE

C15H21BO2 (244.1635)


   

2-ETHYL-5-METHYLPYRAZINE

5-Methyl-2-ethyl-pyrazine

C14H20N4 (244.1688)


2-ethyl-5-methylpyrazine, 9ci, 8ci, also known as 2,5-methylethylpyrazine or fema 3154, is a member of the class of compounds known as pyrazines. Pyrazines are compounds containing a pyrazine ring, which is a six-member aromatic heterocycle, that consists of two nitrogen atoms (at positions 1 and 4) and four carbon atoms. 2-ethyl-5-methylpyrazine, 9ci, 8ci is soluble (in water) and a moderately basic compound (based on its pKa). 2-ethyl-5-methylpyrazine, 9ci, 8ci is a sweet, bean, and coffee tasting compound and can be found in a number of food items such as cereals and cereal products, fenugreek, coffee and coffee products, and tea, which makes 2-ethyl-5-methylpyrazine, 9ci, 8ci a potential biomarker for the consumption of these food products.

   

3-[(1-BENZYL-4-PIPERIDYL)OXY]PROPANENITRILE

3-[(1-BENZYL-4-PIPERIDYL)OXY]PROPANENITRILE

C15H20N2O (244.1576)


   

8-benzyl-2,8-diazaspiro[4.5]decan-3-one

8-benzyl-2,8-diazaspiro[4.5]decan-3-one

C15H20N2O (244.1576)


   

3-Benzyl-7-methyl-3,7-diazabicyclo[3.3.1]nonan-9-one

3-Benzyl-7-methyl-3,7-diazabicyclo[3.3.1]nonan-9-one

C15H20N2O (244.1576)


   

4-METHYL-BETA-STYRYLBORONIC ACID PINACOL ESTER

4-METHYL-BETA-STYRYLBORONIC ACID PINACOL ESTER

C15H21BO2 (244.1635)


   

1-METHYL-3-(1-METHYLPIPERIDIN-4-YL)-1H-INDOL-5-OL

1-METHYL-3-(1-METHYLPIPERIDIN-4-YL)-1H-INDOL-5-OL

C15H20N2O (244.1576)


   

N-BOC-6-azaspiro[3.4]octan-2-ol

N-BOC-6-azaspiro[3.4]octan-2-ol

C15H21BO2 (244.1635)


   

5-METHOXY-3-(1-METHYL-4-PIPERIDINYL)INDOLE

5-METHOXY-3-(1-METHYL-4-PIPERIDINYL)INDOLE

C15H20N2O (244.1576)


   

8-benzyl-2,8-diazaspiro[4.5]decan-1-one

8-benzyl-2,8-diazaspiro[4.5]decan-1-one

C15H20N2O (244.1576)


   

2,3-Dihydro-1H-inden-5-boronic acid, pinacol ester

2,3-Dihydro-1H-inden-5-boronic acid, pinacol ester

C15H21BO2 (244.1635)


   

1-(2-Phenyl-1,3-thiazol-4-yl)ethan-1-one

1-(2-Phenyl-1,3-thiazol-4-yl)ethan-1-one

C14H20N4 (244.1688)


   

2,4/2,6-Diaminotoluene

2,4/2,6-Diaminotoluene

C14H20N4 (244.1688)


   

1,1′-azobis(cyclohexanecarbonitrile)

1,1′-azobis(cyclohexanecarbonitrile)

C14H20N4 (244.1688)


   

diisobutyl glutarate

diisobutyl glutarate

C13H24O4 (244.1675)


   

1-Octyl-2,3-Dimethylimidazolium Chloride

1-Octyl-2,3-Dimethylimidazolium Chloride

C13H25ClN2 (244.1706)


   

diethyl azelate

diethyl azelate

C13H24O4 (244.1675)


   

2-INDANYLBORONIC ACID PINACOL ESTER

2-INDANYLBORONIC ACID PINACOL ESTER

C15H21BO2 (244.1635)


   

4,4,5,5-tetramethyl-2-[(E)-2-(2-methylphenyl)ethenyl]-1,3,2-dioxaborolane

4,4,5,5-tetramethyl-2-[(E)-2-(2-methylphenyl)ethenyl]-1,3,2-dioxaborolane

C15H21BO2 (244.1635)


   

1-(6-Benzyl-2,6-diazaspiro[3.4]oct-2-yl)ethanone

1-(6-Benzyl-2,6-diazaspiro[3.4]oct-2-yl)ethanone

C15H20N2O (244.1576)


   

1,4-Dimethyl-3-[4-(2-methyl-2-propanyl)phenyl]-1H-pyrazol-5-ol

1,4-Dimethyl-3-[4-(2-methyl-2-propanyl)phenyl]-1H-pyrazol-5-ol

C15H20N2O (244.1576)


   

aniline,2-ethylaniline,formaldehyde

aniline,2-ethylaniline,formaldehyde

C15H20N2O (244.1576)


   

Diethyl dipropylmalonate

Diethyl dipropylmalonate

C13H24O4 (244.1675)


   

7-benzyl-2,7-diazaspiro[4.5]decan-1-one

7-benzyl-2,7-diazaspiro[4.5]decan-1-one

C15H20N2O (244.1576)


   

Diethyl 2-isopentyl-2-methylmalonate

Diethyl 2-isopentyl-2-methylmalonate

C13H24O4 (244.1675)


   

4-(Cyclopropyl)phenylboronic acid pinacol ester

4-(Cyclopropyl)phenylboronic acid pinacol ester

C15H21BO2 (244.1635)


   

DiMethyl diisobutylMalonate

DiMethyl diisobutylMalonate

C13H24O4 (244.1675)


   

DI-TERT-BUTYL GLUTARATE

DI-TERT-BUTYL GLUTARATE

C13H24O4 (244.1675)


   

N-[2-(1H-Indol-3-yl)ethyl]-2,2-dimethylpropanamide

N-[2-(1H-Indol-3-yl)ethyl]-2,2-dimethylpropanamide

C15H20N2O (244.1576)


   

diethyl sec-butylethylmalonate

diethyl sec-butylethylmalonate

C13H24O4 (244.1675)


   

2,8-Diazaspiro[4.5]decan-1-one, 2-(phenylmethyl)-

2,8-Diazaspiro[4.5]decan-1-one, 2-(phenylmethyl)-

C15H20N2O (244.1576)


   

1-[trans-4-(5-methyl-1,3-benzoxazol-2-yl)cyclohexyl]methanamine(SALTDATA: FREE)

1-[trans-4-(5-methyl-1,3-benzoxazol-2-yl)cyclohexyl]methanamine(SALTDATA: FREE)

C15H20N2O (244.1576)


   

Diethyl ethyl(1-methylpropyl)malonate

Diethyl ethyl(1-methylpropyl)malonate

C13H24O4 (244.1675)


   

1,9-Nonanediol,1,9-diacetate

1,9-Nonanediol,1,9-diacetate

C13H24O4 (244.1675)


   

Ethylmalonic acid dibutyl ester

Ethylmalonic acid dibutyl ester

C13H24O4 (244.1675)


   

N-cyclohexyl-2,3-dihydroindole-1-carboxamide

N-cyclohexyl-2,3-dihydroindole-1-carboxamide

C15H20N2O (244.1576)


   

1-(adamantan-1-yl)-2-(1H-imidazol-1-yl)ethanone

1-(adamantan-1-yl)-2-(1H-imidazol-1-yl)ethanone

C15H20N2O (244.1576)


   

94042_FLUKA

Undecanedioic acid,1,11-dimethyl ester

C13H24O4 (244.1675)


   

(3R,4R)-4-(hydroxymethyl)-3-[(1R)-1-hydroxyoctyl]oxolan-2-one

(3R,4R)-4-(hydroxymethyl)-3-[(1R)-1-hydroxyoctyl]oxolan-2-one

C13H24O4 (244.1675)


   

Dihydro-4alpha-(hydroxymethyl)-3beta-[(R)-6-methyl-1-hydroxyheptyl]furan-2(3H)-one

Dihydro-4alpha-(hydroxymethyl)-3beta-[(R)-6-methyl-1-hydroxyheptyl]furan-2(3H)-one

C13H24O4 (244.1675)


   
   

(-)-Thermospine

(-)-Thermospine

C15H20N2O (244.1576)


   

N2,N2-dipropylquinazoline-2,4-diamine

N2,N2-dipropylquinazoline-2,4-diamine

C14H20N4 (244.1688)


   

(2S)-1-[(2S)-2,6-bis(azaniumyl)hexanoyl]pyrrolidine-2-carboxylate

(2S)-1-[(2S)-2,6-bis(azaniumyl)hexanoyl]pyrrolidine-2-carboxylate

C11H22N3O3+ (244.1661)


   

5-(2-Amino-4-methylphenyl)imino-3,3-dimethylcyclohexan-1-one

5-(2-Amino-4-methylphenyl)imino-3,3-dimethylcyclohexan-1-one

C15H20N2O (244.1576)


   

N,N-diethyl-2-(5-phenyl-1,2-oxazol-3-yl)ethanamine

N,N-diethyl-2-(5-phenyl-1,2-oxazol-3-yl)ethanamine

C15H20N2O (244.1576)


   

Thermopsine perchlorate

Thermopsine perchlorate

C15H20N2O (244.1576)


   

2,3,4,5-Tetrahydro-1,1,3,3-tetramethyl-1H-pyrido[4,3-b]indol-8-ol

2,3,4,5-Tetrahydro-1,1,3,3-tetramethyl-1H-pyrido[4,3-b]indol-8-ol

C15H20N2O (244.1576)


   

6-Methoxy-2,2,4-trimethyl-1,2,3,4-tetrahydro-gamma-carboline

6-Methoxy-2,2,4-trimethyl-1,2,3,4-tetrahydro-gamma-carboline

C15H20N2O (244.1576)


   

(1R)-3-(3-Butenyl)-1,2,3,4,5,6-hexahydro-1,5-methano-8H-pyrido[1,2-a][1,4]diazocin-8-one

(1R)-3-(3-Butenyl)-1,2,3,4,5,6-hexahydro-1,5-methano-8H-pyrido[1,2-a][1,4]diazocin-8-one

C15H20N2O (244.1576)


Rhombifoline is an alkaloid isolated for the first time from the leaves and stems of A. foetida L.[1]. Rhombifoline is an alkaloid isolated for the first time from the leaves and stems of A. foetida L.[1].

   

Menthyl ethylene glycol carbonate

Menthyl ethylene glycol carbonate

C13H24O4 (244.1675)


   

1,4-Nonanediol diacetate

1,4-Nonanediol diacetate

C13H24O4 (244.1675)


   

Lys-Pro(1+)

Lys-Pro(1+)

C11H22N3O3 (244.1661)


A peptide cation obtained by deprotonation of the carboxy terminus and protonation of the side-chain amino group and the amino terminus of Lys-Pro; major species at pH 7.3.

   
   

NA-Tryptamine 5:0

NA-Tryptamine 5:0

C15H20N2O (244.1576)


   

FAHFA 4:0/3O-9:0

FAHFA 4:0/3O-9:0

C13H24O4 (244.1675)


   

FAHFA 5:0/3O-8:0

FAHFA 5:0/3O-8:0

C13H24O4 (244.1675)


   

FAHFA 7:0/3O-6:0

FAHFA 7:0/3O-6:0

C13H24O4 (244.1675)


   
   

methyl 3-hydroxy-11-oxododecanoate

methyl 3-hydroxy-11-oxododecanoate

C13H24O4 (244.1675)


   

1-[2-hydroxy-4-(hydroxymethyl)-5,6-dimethyloxan-3-yl]-2-methylbutan-1-one

1-[2-hydroxy-4-(hydroxymethyl)-5,6-dimethyloxan-3-yl]-2-methylbutan-1-one

C13H24O4 (244.1675)


   

(1r,9r,10s)-7,15-diazatetracyclo[7.7.1.0²,⁷.0¹⁰,¹⁵]heptadeca-2,4-dien-6-one

(1r,9r,10s)-7,15-diazatetracyclo[7.7.1.0²,⁷.0¹⁰,¹⁵]heptadeca-2,4-dien-6-one

C15H20N2O (244.1576)


   

ethyl (2r)-2-[(2r,5s)-5-[(2s)-2-hydroxybutyl]oxolan-2-yl]propanoate

ethyl (2r)-2-[(2r,5s)-5-[(2s)-2-hydroxybutyl]oxolan-2-yl]propanoate

C13H24O4 (244.1675)


   

5-(3-hydroxybut-1-en-1-yl)-4-(hydroxymethyl)-4,6-dimethylcyclohexane-1,3-diol

5-(3-hydroxybut-1-en-1-yl)-4-(hydroxymethyl)-4,6-dimethylcyclohexane-1,3-diol

C13H24O4 (244.1675)


   

2-(prop-2-en-1-yl)-1,8-diazatetracyclo[8.3.1.0³,⁸.0³,¹²]tetradec-4-en-7-one

2-(prop-2-en-1-yl)-1,8-diazatetracyclo[8.3.1.0³,⁸.0³,¹²]tetradec-4-en-7-one

C15H20N2O (244.1576)


   

4-(hydroxymethyl)-3-(1-hydroxyoctyl)oxolan-2-one

4-(hydroxymethyl)-3-(1-hydroxyoctyl)oxolan-2-one

C13H24O4 (244.1675)


   

2-[5-(3-hydroxyhexan-2-yl)oxolan-2-yl]propanoic acid

2-[5-(3-hydroxyhexan-2-yl)oxolan-2-yl]propanoic acid

C13H24O4 (244.1675)


   

(1s,3s,4r,5s,6r)-5-[(1e,3r)-3-hydroxybut-1-en-1-yl]-4-(hydroxymethyl)-4,6-dimethylcyclohexane-1,3-diol

(1s,3s,4r,5s,6r)-5-[(1e,3r)-3-hydroxybut-1-en-1-yl]-4-(hydroxymethyl)-4,6-dimethylcyclohexane-1,3-diol

C13H24O4 (244.1675)


   

(3S,SR,6R,7E;9S)-megastiman-7-ene-3,5,6,9-tetrol

NA

C13H24O4 (244.1675)


{"Ingredient_id": "HBIN009731","Ingredient_name": "(3S,SR,6R,7E;9S)-megastiman-7-ene-3,5,6,9-tetrol","Alias": "NA","Ingredient_formula": "C13H24O4","Ingredient_Smile": "CC(C=CC1(C(CC(CC1(C)O)O)(C)C)O)O","Ingredient_weight": "NA","OB_score": "NA","CAS_id": "NA","SymMap_id": "NA","TCMID_id": "42641","TCMSP_id": "NA","TCM_ID_id": "NA","PubChem_id": "NA","DrugBank_id": "NA"}

   

anagyrine

FYU1U980Q9; 5-24-03-00410 (Beilstein Handbook Reference); (1R,9R,10R)-7,15-DIAZATETRACYCLO[7.7.1.0(2),?.0(1)?,(1)?]HEPTADECA-2,4-DIEN-6-ONE; BRN 0086776; ANAGYRINE; (-)-Anagyrine; UNII-FYU1U980Q9; 7,7a,8,9,10,11,13,14-Octahydro-7,14-memethano-4H,6H-dipyrido(1,2-a:1',2'-e)(1,5)diazocin-4-one; 3,4,5,6-Tetradehydrospartein-2-one; (7alpha)-11,12,13,14-tetradehydrospartein-15-one; (-)-anagyrine; CHEMBL509692; Rhombinine; Anagyrine; AC1LE9O5; NSC76019; ZINC900282; Monolupine; 486-89-5

C15H20N2O (244.1576)


{"Ingredient_id": "HBIN015975","Ingredient_name": "anagyrine","Alias": "FYU1U980Q9; 5-24-03-00410 (Beilstein Handbook Reference); (1R,9R,10R)-7,15-DIAZATETRACYCLO[7.7.1.0(2),?.0(1)?,(1)?]HEPTADECA-2,4-DIEN-6-ONE; BRN 0086776; ANAGYRINE; (-)-Anagyrine; UNII-FYU1U980Q9; 7,7a,8,9,10,11,13,14-Octahydro-7,14-memethano-4H,6H-dipyrido(1,2-a:1',2'-e)(1,5)diazocin-4-one; 3,4,5,6-Tetradehydrospartein-2-one; (7alpha)-11,12,13,14-tetradehydrospartein-15-one; (-)-anagyrine; CHEMBL509692; Rhombinine; Anagyrine; AC1LE9O5; NSC76019; ZINC900282; Monolupine; 486-89-5","Ingredient_formula": "C15H20N2O","Ingredient_Smile": "C1CCN2CC3CC(C2C1)CN4C3=CC=CC4=O","Ingredient_weight": "244.33 g/mol","OB_score": "NA","CAS_id": "NA","SymMap_id": "SMIT01268;SMIT05719","TCMID_id": "1134","TCMSP_id": "MOL003687;MOL006571","TCM_ID_id": "6815;17611","PubChem_id": "71056954","DrugBank_id": "NA"}

   

(9r,10s)-7,15-diazatetracyclo[7.7.1.0²,⁷.0¹⁰,¹⁵]heptadeca-2,4-dien-6-one

(9r,10s)-7,15-diazatetracyclo[7.7.1.0²,⁷.0¹⁰,¹⁵]heptadeca-2,4-dien-6-one

C15H20N2O (244.1576)


   

(1r,9s)-11-(but-3-en-1-yl)-7,11-diazatricyclo[7.3.1.0²,⁷]trideca-2,4-dien-6-one

(1r,9s)-11-(but-3-en-1-yl)-7,11-diazatricyclo[7.3.1.0²,⁷]trideca-2,4-dien-6-one

C15H20N2O (244.1576)


   

(-)-anagyrine

(-)-anagyrine

C15H20N2O (244.1576)


   

2-(prop-2-en-1-yl)-1,8-diazatetracyclo[8.3.1.0³,⁸.0³,¹²]tetradec-5-en-7-one

2-(prop-2-en-1-yl)-1,8-diazatetracyclo[8.3.1.0³,⁸.0³,¹²]tetradec-5-en-7-one

C15H20N2O (244.1576)


   

ethyl (2s)-2-[(2s,5r)-5-[(2r)-2-hydroxybutyl]oxolan-2-yl]propanoate

ethyl (2s)-2-[(2s,5r)-5-[(2r)-2-hydroxybutyl]oxolan-2-yl]propanoate

C13H24O4 (244.1675)


   

3-(1-hydroxy-6-methylheptyl)-4-(hydroxymethyl)oxolan-2-one

3-(1-hydroxy-6-methylheptyl)-4-(hydroxymethyl)oxolan-2-one

C13H24O4 (244.1675)


   

2-[(3s)-heptan-3-yl]quinazolin-4-ol

2-[(3s)-heptan-3-yl]quinazolin-4-ol

C15H20N2O (244.1576)


   

(2s,3s)-2-methyl-3-octylbutanedioic acid

(2s,3s)-2-methyl-3-octylbutanedioic acid

C13H24O4 (244.1675)


   

(9r,10r)-7,15-diazatetracyclo[7.7.1.0²,⁷.0¹⁰,¹⁵]heptadeca-2,4-dien-6-one

(9r,10r)-7,15-diazatetracyclo[7.7.1.0²,⁷.0¹⁰,¹⁵]heptadeca-2,4-dien-6-one

C15H20N2O (244.1576)


   

2-[(3r)-heptan-3-yl]quinazolin-4-ol

2-[(3r)-heptan-3-yl]quinazolin-4-ol

C15H20N2O (244.1576)


   

(3r,4r)-3-(1-hydroxy-6-methylheptyl)-4-(hydroxymethyl)oxolan-2-one

(3r,4r)-3-(1-hydroxy-6-methylheptyl)-4-(hydroxymethyl)oxolan-2-one

C13H24O4 (244.1675)


   

(1r,9s,10s)-7,15-diazatetracyclo[7.7.1.0²,⁷.0¹⁰,¹⁵]heptadeca-2,4-dien-6-one

(1r,9s,10s)-7,15-diazatetracyclo[7.7.1.0²,⁷.0¹⁰,¹⁵]heptadeca-2,4-dien-6-one

C15H20N2O (244.1576)


   

(1s,9r,10r)-11-methyl-10-(prop-2-en-1-yl)-7,11-diazatricyclo[7.3.1.0²,⁷]trideca-2,4-dien-6-one

(1s,9r,10r)-11-methyl-10-(prop-2-en-1-yl)-7,11-diazatricyclo[7.3.1.0²,⁷]trideca-2,4-dien-6-one

C15H20N2O (244.1576)


   

(1r,2r,4s)-1-[(1e,3r)-3-hydroxybut-1-en-1-yl]-2,6,6-trimethylcyclohexane-1,2,4-triol

(1r,2r,4s)-1-[(1e,3r)-3-hydroxybut-1-en-1-yl]-2,6,6-trimethylcyclohexane-1,2,4-triol

C13H24O4 (244.1675)


   

2-ethyl-2,5-dimethyl-3-(2-phenylethyl)imidazol-4-one

2-ethyl-2,5-dimethyl-3-(2-phenylethyl)imidazol-4-one

C15H20N2O (244.1576)


   

2-octylpentanedioic acid

2-octylpentanedioic acid

C13H24O4 (244.1675)


   

(2s)-2-[(2r,5s)-5-[(2s,3s)-3-hydroxyhexan-2-yl]oxolan-2-yl]propanoic acid

(2s)-2-[(2r,5s)-5-[(2s,3s)-3-hydroxyhexan-2-yl]oxolan-2-yl]propanoic acid

C13H24O4 (244.1675)


   

(1s,9r)-11-(but-3-en-1-yl)-7,11-diazatricyclo[7.3.1.0²,⁷]trideca-2,4-dien-6-one

(1s,9r)-11-(but-3-en-1-yl)-7,11-diazatricyclo[7.3.1.0²,⁷]trideca-2,4-dien-6-one

C15H20N2O (244.1576)


   

n-[2-(1h-indol-3-yl)ethyl]-3-methylbutanimidic acid

n-[2-(1h-indol-3-yl)ethyl]-3-methylbutanimidic acid

C15H20N2O (244.1576)


   

(1s,2s,4r)-1-[(3s)-3-hydroxybut-1-en-1-yl]-2,6,6-trimethylcyclohexane-1,2,4-triol

(1s,2s,4r)-1-[(3s)-3-hydroxybut-1-en-1-yl]-2,6,6-trimethylcyclohexane-1,2,4-triol

C13H24O4 (244.1675)


   

methyl (3r)-3-hydroxy-11-oxododecanoate

methyl (3r)-3-hydroxy-11-oxododecanoate

C13H24O4 (244.1675)


   

(3s,5s)-3-[(1r)-1-hydroxy-6-methylheptyl]-5-(hydroxymethyl)oxolan-2-one

(3s,5s)-3-[(1r)-1-hydroxy-6-methylheptyl]-5-(hydroxymethyl)oxolan-2-one

C13H24O4 (244.1675)


   

2-(heptan-3-yl)quinazolin-4-ol

2-(heptan-3-yl)quinazolin-4-ol

C15H20N2O (244.1576)


   

(2r,3r,10s,12r)-2-(prop-2-en-1-yl)-1,8-diazatetracyclo[8.3.1.0³,⁸.0³,¹²]tetradec-5-en-7-one

(2r,3r,10s,12r)-2-(prop-2-en-1-yl)-1,8-diazatetracyclo[8.3.1.0³,⁸.0³,¹²]tetradec-5-en-7-one

C15H20N2O (244.1576)


   

1-(3-hydroxybut-1-en-1-yl)-2,6,6-trimethylcyclohexane-1,2,4-triol

1-(3-hydroxybut-1-en-1-yl)-2,6,6-trimethylcyclohexane-1,2,4-triol

C13H24O4 (244.1675)


   

11-methyl-10-(prop-2-en-1-yl)-7,11-diazatricyclo[7.3.1.0²,⁷]trideca-2,4-dien-6-one

11-methyl-10-(prop-2-en-1-yl)-7,11-diazatricyclo[7.3.1.0²,⁷]trideca-2,4-dien-6-one

C15H20N2O (244.1576)


   

(2s)-1-[(2s,3s,4r,5s,6s)-2-hydroxy-4-(hydroxymethyl)-5,6-dimethyloxan-3-yl]-2-methylbutan-1-one

(2s)-1-[(2s,3s,4r,5s,6s)-2-hydroxy-4-(hydroxymethyl)-5,6-dimethyloxan-3-yl]-2-methylbutan-1-one

C13H24O4 (244.1675)


   

(1r,2r,4s)-1-[(1e,3s)-3-hydroxybut-1-en-1-yl]-2,6,6-trimethylcyclohexane-1,2,4-triol

(1r,2r,4s)-1-[(1e,3s)-3-hydroxybut-1-en-1-yl]-2,6,6-trimethylcyclohexane-1,2,4-triol

C13H24O4 (244.1675)


   

(3r,4r)-3-[(1r)-1-hydroxy-6-methylheptyl]-4-(hydroxymethyl)oxolan-2-one

(3r,4r)-3-[(1r)-1-hydroxy-6-methylheptyl]-4-(hydroxymethyl)oxolan-2-one

C13H24O4 (244.1675)


   

(1s,9r,10s)-7,15-diazatetracyclo[7.7.1.0²,⁷.0¹⁰,¹⁵]heptadeca-2,4-dien-6-one

(1s,9r,10s)-7,15-diazatetracyclo[7.7.1.0²,⁷.0¹⁰,¹⁵]heptadeca-2,4-dien-6-one

C15H20N2O (244.1576)


   

(1s,9r,17s)-7,13-diazatetracyclo[7.7.1.0²,⁷.0¹³,¹⁷]heptadeca-2,4-dien-6-one

(1s,9r,17s)-7,13-diazatetracyclo[7.7.1.0²,⁷.0¹³,¹⁷]heptadeca-2,4-dien-6-one

C15H20N2O (244.1576)


   

ethyl 2-[5-(2-hydroxybutyl)oxolan-2-yl]propanoate

ethyl 2-[5-(2-hydroxybutyl)oxolan-2-yl]propanoate

C13H24O4 (244.1675)


   

(2r)-2-hydroxy-4-[(1s,4r,6r)-4-hydroxy-2,2,6-trimethylcyclohexyl]butanoic acid

(2r)-2-hydroxy-4-[(1s,4r,6r)-4-hydroxy-2,2,6-trimethylcyclohexyl]butanoic acid

C13H24O4 (244.1675)


   

(1s,9s,10s)-7,15-diazatetracyclo[7.7.1.0²,⁷.0¹⁰,¹⁵]heptadeca-2,5-dien-4-one

(1s,9s,10s)-7,15-diazatetracyclo[7.7.1.0²,⁷.0¹⁰,¹⁵]heptadeca-2,5-dien-4-one

C15H20N2O (244.1576)


   

2-hydroxy-4-(4-hydroxy-2,2,6-trimethylcyclohexyl)butanoic acid

2-hydroxy-4-(4-hydroxy-2,2,6-trimethylcyclohexyl)butanoic acid

C13H24O4 (244.1675)


   

(2s,3r,10s,12r)-2-(prop-2-en-1-yl)-1,8-diazatetracyclo[8.3.1.0³,⁸.0³,¹²]tetradec-4-en-7-one

(2s,3r,10s,12r)-2-(prop-2-en-1-yl)-1,8-diazatetracyclo[8.3.1.0³,⁸.0³,¹²]tetradec-4-en-7-one

C15H20N2O (244.1576)


   

7,15-diazatetracyclo[7.7.1.0²,⁷.0¹⁰,¹⁵]heptadeca-2,5-dien-4-one

7,15-diazatetracyclo[7.7.1.0²,⁷.0¹⁰,¹⁵]heptadeca-2,5-dien-4-one

C15H20N2O (244.1576)


   

(2r)-n-[2-(1h-indol-3-yl)ethyl]-2-methylbutanimidic acid

(2r)-n-[2-(1h-indol-3-yl)ethyl]-2-methylbutanimidic acid

C15H20N2O (244.1576)


   

(1r,9r,10r)-11-methyl-10-(prop-2-en-1-yl)-7,11-diazatricyclo[7.3.1.0²,⁷]trideca-2,4-dien-6-one

(1r,9r,10r)-11-methyl-10-(prop-2-en-1-yl)-7,11-diazatricyclo[7.3.1.0²,⁷]trideca-2,4-dien-6-one

C15H20N2O (244.1576)


   

(1s,2s,4r)-1-[(1e,3s)-3-hydroxybut-1-en-1-yl]-2,6,6-trimethylcyclohexane-1,2,4-triol

(1s,2s,4r)-1-[(1e,3s)-3-hydroxybut-1-en-1-yl]-2,6,6-trimethylcyclohexane-1,2,4-triol

C13H24O4 (244.1675)


   

(1r,9r,10r)-7,15-diazatetracyclo[7.7.1.0²,⁷.0¹⁰,¹⁵]heptadeca-2,4-dien-6-one

(1r,9r,10r)-7,15-diazatetracyclo[7.7.1.0²,⁷.0¹⁰,¹⁵]heptadeca-2,4-dien-6-one

C15H20N2O (244.1576)


   

(1s,9r,10s)-7,15-diazatetracyclo[7.7.1.0²,⁷.0¹⁰,¹⁵]heptadeca-2,5-dien-4-one

(1s,9r,10s)-7,15-diazatetracyclo[7.7.1.0²,⁷.0¹⁰,¹⁵]heptadeca-2,5-dien-4-one

C15H20N2O (244.1576)


   

(1r,9s,10r)-11-methyl-10-(prop-2-en-1-yl)-7,11-diazatricyclo[7.3.1.0²,⁷]trideca-2,4-dien-6-one

(1r,9s,10r)-11-methyl-10-(prop-2-en-1-yl)-7,11-diazatricyclo[7.3.1.0²,⁷]trideca-2,4-dien-6-one

C15H20N2O (244.1576)


   

1,11-dimethyl undecanedioate

1,11-dimethyl undecanedioate

C13H24O4 (244.1675)