Exact Mass: 320.319132

Exact Mass Matches: 320.319132

Found 116 metabolites which its exact mass value is equals to given mass value 320.319132, within given mass tolerance error 0.05 dalton. Try search metabolite list with more accurate mass tolerance error 0.01 dalton.

Pregnanediol

(1S,2S,5R,7R,10R,11S,14S,15S)-14-[(1S)-1-hydroxyethyl]-2,15-dimethyltetracyclo[8.7.0.0^{2,7}.0^{11,15}]heptadecan-5-ol

C21H36O2 (320.2715156)


Pregnanediol is an endogenous human testosterone metabolite. It can be detected in the urine of adults and newborns in variable concentrations. Pregnanediol is abnormally elevated in patients with cytochrome P450 (P450C17, steroid 17alpha-monooxygenase, EC 1.14.99.9) oxidoreductase deficiency (Antley-Bixler syndrome, PORD, OMIM: 201750). Antley-Bixler syndrome is a multiple congenital malformation syndrome with craniosynostosis, radiohumeral synostosis, femoral bowing, choanal atresia or stenosis, joint contractures, urogenital abnormalities, and often early death. An assay of urinary pregnanediol excretion provides an accurate indication of outcome in threatened miscarriage in 74 - 93\\\% percent of cases. Pregnanediol is one of the most important markers of pregnenolone administration, which can potentially be abused by athletes to maintain an equilibration of the steroidal environment after sex steroids administrations. Patients with recurrent vulvovaginal candidiasis have significantly lower levels of urinary pregnanediol (PMID: 126703, 16608896, 16906539, 1191599, 2905284, 15763596, 10360427, 11159778, 16687200). Pregnanediol excretion is low in women with suspected placental insufficiency and in women with uterine fibroma. Pregnanediol levels can change in endocrine disturbances such as hirsutism or Cushings syndrome, depending on the stage of the disease. Pregnanediol has been tried as a more reliable compound to measure in screening of urinary steroids when suspecting doping, due to its not significant isotopic fractionation that could lead to false positive results in anti-doping testing. 13C-Enrichment caused by a diet change might be a reason of concern in athletes that move around between places and might have a considerable change of diet between competitions. In contrast to the results obtained with the carbon isotopic ratio, the profiling of urinary testosterone/epitestosterone (T/E) ratios is found to be unaffected by a diet change (PMID: 16338181, 5172227, 13636945, 14440289). Pregnanediol is an endogenous human testosterone metabolite. It can be detected in adults and newborns urine in variable concentrations. Pregnanediol is abnormally elevated in patients with cytochrome P450 (P450C17, steroid 17alpha-monooxygenase, EC 1.14.99.9) oxidoreductase deficiency (Antley-Bixler syndrome, PORD, OMIM 201750). Antley-Bixler syndrome is a multiple congenital malformation syndrome with craniosynostosis, radiohumeral synostosis, femoral bowing, choanal atresia or stenosis, joint contractures, urogenital abnormalities and, often, early death. An assay of urinary pregnanediol excretion provides an accurate indication of outcome in threatened abortion in 74 - 93\\\% per cent of cases. Pregnanediol is one of the most important markers of pregnenolone administration, which can potentially be abused by athletes to maintain an equilibration of the steroidal environment after sex steroids administrations. Patients with recurrent vulvovaginal candidiasis have significantly lower levels of urinary pregnanediol. (PMID: 126703, 16608896, 16906539, 1191599, 2905284, 15763596, 10360427, 11159778, 16687200) [HMDB] C147908 - Hormone Therapy Agent > C548 - Therapeutic Hormone > C1636 - Therapeutic Steroid Hormone D006730 - Hormones, Hormone Substitutes, and Hormone Antagonists > D006728 - Hormones Pregnanediol is the major metabolite of progesterone and can be excreted via urine. Pregnanediol offers an indirect way to measure progesterone levels in vivo[1].

   

Adipostatin A

5-pentadecylbenzene-1,3-diol

C21H36O2 (320.2715156)


Isolated from cereals and other plants. Adipostatin A is found in many foods, some of which are hard wheat, rye, cereals and cereal products, and common wheat. Adipostatin A is found in barley. Adipostatin A is isolated from cereals and other plant 5-Pentadecylresorcinol (Adipostatin A) is a glycerol-3-phosphate dehydrogenase (GPDH) inhibitor with an IC50 of 4.1 μM. Adipostatin A shows good larvicidal activity against Aedes aegypti[1][2]. 5-Pentadecylresorcinol (Adipostatin A) is a glycerol-3-phosphate dehydrogenase (GPDH) inhibitor with an IC50 of 4.1 μM. Adipostatin A shows good larvicidal activity against Aedes aegypti[1][2].

   

NCIOpen2_007671

6alpha,17-Dimethyl-5alpha-androstane-3beta,17beta-diol

C21H36O2 (320.2715156)


   

11,17-Dimethyl-5alpha-androstane-11beta,17beta-diol

11,17-Dimethyl-5alpha-androstane-11beta,17beta-diol

C21H36O2 (320.2715156)


   

3-Ethyl-5alpha-androstane-3alpha,17beta-diol

3-Ethyl-5alpha-androstane-3alpha,17beta-diol

C21H36O2 (320.2715156)


   

5alpha-Pregnane-3alpha,20alpha-diol

(3R,5S,8R,9S,10S,13S,14S,17S)-17-[(1S)-1-hydroxyethyl]-10,13-dimethyl-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthren-3-ol

C21H36O2 (320.2715156)


This compound belongs to the family of Gluco/mineralocorticoids, Progestogins and Derivatives. These are steroids whose structure is based on an hydroxylated prostane moiety.

   

3beta-Hydroxy-4beta-hydroxymethyl-4alpha-methylsteroid

3beta-Hydroxy-4beta-hydroxymethyl-4alpha-methylsteroid

C21H36O2 (320.2715156)


   

6beta,17-Dimethyl-5alpha-androstane-3beta,17beta-diol

6beta,17-Dimethyl-5alpha-androstane-3beta,17beta-diol

C21H36O2 (320.2715156)


   

3a,20b-Pregnanediol

(1S,2S,5R,10R,11S,14S,15S)-14-[(1S)-1-hydroxyethyl]-2,15-dimethyltetracyclo[8.7.0.0²,⁷.0¹¹,¹⁵]heptadecan-5-ol

C21H36O2 (320.2715156)


C147908 - Hormone Therapy Agent > C548 - Therapeutic Hormone > C1636 - Therapeutic Steroid Hormone Complex steroid in human breast milk that inhibits hepatic glucuronyl transferase (PMID: 4246186). Complex steroid in human breast milk that inhibits hepatic glucuronyl transferase (4246186) [HMDB] D006730 - Hormones, Hormone Substitutes, and Hormone Antagonists > D006728 - Hormones Pregnanediol is the major metabolite of progesterone and can be excreted via urine. Pregnanediol offers an indirect way to measure progesterone levels in vivo[1].

   

1-Hydroxy-2,12,15-heneicosatrien-4-one

(2E,12E,15E)-1-hydroxyhenicosa-2,12,15-trien-4-one

C21H36O2 (320.2715156)


1-Hydroxy-2,12,15-heneicosatrien-4-one is found in fruits. 1-Hydroxy-2,12,15-heneicosatrien-4-one is a constituent of avocado (Persea americana). Constituent of avocado (Persea americana). 1-Hydroxy-2,12,15-heneicosatrien-4-one is found in fruits.

   

7a,17-dimethyl-5b-Androstane-3a,17b-diol

(1S,2S,5R,7R,9R,10R,11S,14S,15S)-2,9,14,15-tetramethyltetracyclo[8.7.0.0²,⁷.0¹¹,¹⁵]heptadecane-5,14-diol

C21H36O2 (320.2715156)


7a,17-dimethyl-5b-Androstane-3a,17b-diol is a urinary metabolite of the anabolic androgenic steroid (AAS) bolasterone. Androgenic anabolic steroids are defined as natural, synthetic or semi-synthetic drugs chemicals derived from testosterone, used with the aim to improve physical performance by increasing both muscle strength and mass. Despite their reported toxicological effects on the cardiovascular, hepatic and neuro-endocrine systems, the AAS have been extensively used in sports activities. The use of anabolic steroids was banned by the International Olympic Committee for the first time at the Olympic Games in Montreal in 1976. Since that time the misuse of anabolic steroids by athletes has been controlled by analysis of urine of the excreted steroids or their metabolites, or both. (PMID: 10932808, 14976846, 15042372, 15231229, 16195040, 16292586, 1663826, 16799097, 16888758, 16923823, 17667636, 17723876, 17723877, 2079979, 3308301, 8456050, 8674183, 8725393, 9216475) [HMDB] 7a,17-dimethyl-5b-Androstane-3a,17b-diol is a urinary metabolite of the anabolic androgenic steroid (AAS) bolasterone. Androgenic anabolic steroids are defined as natural, synthetic or semi-synthetic drugs chemicals derived from testosterone, used with the aim to improve physical performance by increasing both muscle strength and mass. Despite their reported toxicological effects on the cardiovascular, hepatic and neuro-endocrine systems, the AAS have been extensively used in sports activities. The use of anabolic steroids was banned by the International Olympic Committee for the first time at the Olympic Games in Montreal in 1976. Since that time the misuse of anabolic steroids by athletes has been controlled by analysis of urine of the excreted steroids or their metabolites, or both. (PMID: 10932808, 14976846, 15042372, 15231229, 16195040, 16292586, 1663826, 16799097, 16888758, 16923823, 17667636, 17723876, 17723877, 2079979, 3308301, 8456050, 8674183, 8725393, 9216475).

   

5beta-Pregnane-3alpha,20alpha-diol

14-(1-hydroxyethyl)-2,15-dimethyltetracyclo[8.7.0.0²,⁷.0¹¹,¹⁵]heptadecan-5-ol

C21H36O2 (320.2715156)


   

Cativic acid methyl ester

Cativic acid methyl ester

C21H36O2 (320.2715156)


   

Adipostatin B

5-(13-methyl)tetradecylbenzene-1,3-diol

C21H36O2 (320.2715156)


   

Eperuic acid methyl ester

Eperuic acid methyl ester

C21H36O2 (320.2715156)


   
   

methyl icosa-5,8,11-trienoate

methyl icosa-5,8,11-trienoate

C21H36O2 (320.2715156)


   

methyl icosa-8,11,14-trienoate

methyl icosa-8,11,14-trienoate

C21H36O2 (320.2715156)


   

pentadecylresorcinol

pentadecylresorcinol

C21H36O2 (320.2715156)


   

1,14-Tricosadiene, (Z)-

1,14-Tricosadiene, (Z)-

C23H44 (320.3442824)


   

Labd-8-en-15-methylester|labd-8-en-15-oic acid methyl ester

Labd-8-en-15-methylester|labd-8-en-15-oic acid methyl ester

C21H36O2 (320.2715156)


   
   
   

1,3-Dimethoxy-5-tridecylbenzene

1,3-Dimethoxy-5-tridecylbenzene

C21H36O2 (320.2715156)


   
   

Labd-7-en-15-oic acid, methyl ester

Labd-7-en-15-oic acid, methyl ester

C21H36O2 (320.2715156)


   

(13S)-13-hydroxy-19-methoxy-5alphaH-8(17),14-labdadien

(13S)-13-hydroxy-19-methoxy-5alphaH-8(17),14-labdadien

C21H36O2 (320.2715156)


   

Methyl 5,11,14-eicosatrienoate

Methyl 5,11,14-eicosatrienoate

C21H36O2 (320.2715156)


   

4-pentadecylbenzene-1,2-diol

4-pentadecylbenzene-1,2-diol

C21H36O2 (320.2715156)


   
   

3-Pentadecylcatechol

3-Pentadecylcatechol

C21H36O2 (320.2715156)


   

9,10-Tricosadiene

9,10-Tricosadiene

C23H44 (320.3442824)


   

D-HOMO-5-|A-ANDROSTAN-17-|A-METHYL-3-|A, 17A-|A-DIOL

D-HOMO-5-|A-ANDROSTAN-17-|A-METHYL-3-|A, 17A-|A-DIOL

C21H36O2 (320.2715156)


   

2beta,15alpha-dihydroxy-ent-kaur-16-ene

2beta,15alpha-dihydroxy-ent-kaur-16-ene

C21H36O2 (320.2715156)


   

(1S,2E,4S,6E,8S,11E)-2,6,11-cembratriene-8-O-methyl-4,8-diol

(1S,2E,4S,6E,8S,11E)-2,6,11-cembratriene-8-O-methyl-4,8-diol

C21H36O2 (320.2715156)


   

(1S,2E,4R,6R,7E,11E)-2,7,11-cembratriene-4-O-methyl-4,6-diol

(1S,2E,4R,6R,7E,11E)-2,7,11-cembratriene-4-O-methyl-4,6-diol

C21H36O2 (320.2715156)


   

Ladp-8(20)-en-15-oic aicd, methyl ester

Ladp-8(20)-en-15-oic aicd, methyl ester

C21H36O2 (320.2715156)


   

16beta-methoxy-17-hydroxyl-ent-kaurane|ent-16alpha-methoxykauran-17-ol|ent-16??-Methoxy-kauran-17-ol

16beta-methoxy-17-hydroxyl-ent-kaurane|ent-16alpha-methoxykauran-17-ol|ent-16??-Methoxy-kauran-17-ol

C21H36O2 (320.2715156)


   

methyl labd-13E-en-15-oate

methyl labd-13E-en-15-oate

C21H36O2 (320.2715156)


   

Methyldihydrokolavenat|populifolic acid methyl ester|Populifolin-saeure-methylester

Methyldihydrokolavenat|populifolic acid methyl ester|Populifolin-saeure-methylester

C21H36O2 (320.2715156)


   

9S,10R-Epoxide-(3Z,6Z,9Z)-3,6,9-Docosatriene

9S,10R-Epoxide-(3Z,6Z,9Z)-3,6,9-Docosatriene

C22H40O (320.307899)


   

henicosa-6-yn-20-en-1-oic acid

henicosa-6-yn-20-en-1-oic acid

C21H36O2 (320.2715156)


   

14-methoxy-13,14-dihydroanisotom-12E-ene-1-ol

14-methoxy-13,14-dihydroanisotom-12E-ene-1-ol

C21H36O2 (320.2715156)


   

ent-16alpha-17-kauranol

ent-16alpha-17-kauranol

C21H36O2 (320.2715156)


   

Adipostatin A

5-Pentadecylresorcinol

C21H36O2 (320.2715156)


5-Pentadecylresorcinol (Adipostatin A) is a glycerol-3-phosphate dehydrogenase (GPDH) inhibitor with an IC50 of 4.1 μM. Adipostatin A shows good larvicidal activity against Aedes aegypti[1][2]. 5-Pentadecylresorcinol (Adipostatin A) is a glycerol-3-phosphate dehydrogenase (GPDH) inhibitor with an IC50 of 4.1 μM. Adipostatin A shows good larvicidal activity against Aedes aegypti[1][2].

   

3-pentadecylbenzene-1,2-diol

NCGC00386000-01!3-pentadecylbenzene-1,2-diol

C21H36O2 (320.2715156)


   

h_38_pregnanediol

h_38_pregnanediol

C21H36O2 (320.2715156)


   

h_69_Calusterone-m

h_69_Calusterone-m

C21H36O2 (320.2715156)


   

h_58_bolasterone-m

h_58_bolasterone-m

C21H36O2 (320.2715156)


   

Dihomo-γ-Linolenic acid methyl ester

cis-8,11,14-Eicosatrienoic acid methyl ester

C21H36O2 (320.2715156)


   

3a,20b-Pregnanediol

3a,20b-Pregnanediol

C21H36O2 (320.2715156)


   

7a,17-dimethyl-5b-Androstane-3a,17b-diol

(3a,5b,7a,17b)-7,17-Dimethyl-androstane-3,17-diol

C21H36O2 (320.2715156)


   

Med Acid methyl ester

5(Z),8(Z),11(Z)-Eicosatrienoic Acid methyl ester

C21H36O2 (320.2715156)


   

C21:3n-4,7,16

5Z,14Z,17Z-heneicosatrienoic acid

C21H36O2 (320.2715156)


   

1-Hydroxy-2,12,15-heneicosatrien-4-one

(2E,12E,15E)-1-hydroxyhenicosa-2,12,15-trien-4-one

C21H36O2 (320.2715156)


   

WE(12:3(2E,6E,10E)(3Me,7Me,11Me)/6:0)

(E,E)-3,7,11-Trimethyl-2,6,10-dodecatrienyl hexanoate

C21H36O2 (320.2715156)


   

6Z,9Z-Tricosadiene

6Z,9Z-Tricosadiene

C23H44 (320.3442824)


   

5,9-Tricosadiene

5,9-Tricosadiene

C23H44 (320.3442824)


   

7E,9E-Heneicosadien-6,11-one

7E,9E-Heneicosadien-6,11-one

C21H36O2 (320.2715156)


   

FA 21:3

8-(2-((2-((2-ethylcyclopropyl)methyl)cyclopropyl)methyl)cyclopropyl)octanoic acid

C21H36O2 (320.2715156)


   

FOH 22:3

(3R)-13-methylheneicos-(4E)-en-1-yn-3-ol

C22H40O (320.307899)


   

FOH 21:4;O

(2E,12E,15E)-1-hydroxyhenicosa-2,12,15-trien-4-one

C21H36O2 (320.2715156)


   

WE 21:3

(E,E)-3,7,11-Trimethyl-2,6,10-dodecatrienyl hexanoate

C21H36O2 (320.2715156)


   

ST 21:0;O2

7a,17-dimethyl-5b-Androstane-3a,17b-diol

C21H36O2 (320.2715156)


   

Pregnanediol

5beta-Pregnane-3alpha,20alpha-diol

C21H36O2 (320.2715156)


C147908 - Hormone Therapy Agent > C548 - Therapeutic Hormone > C1636 - Therapeutic Steroid Hormone D006730 - Hormones, Hormone Substitutes, and Hormone Antagonists > D006728 - Hormones Pregnanediol is the major metabolite of progesterone and can be excreted via urine. Pregnanediol offers an indirect way to measure progesterone levels in vivo[1].

   

3-(pentadecyl)-catechol

3-pentadecylbenzene-1,2-diol

C21H36O2 (320.2715156)


   

5-ALPHA-PREGNAN-3-ALPHA, 20-BETA-DIOL

5-ALPHA-PREGNAN-3-ALPHA, 20-BETA-DIOL

C21H36O2 (320.2715156)


   

methyl icosa-11,14,17-trienoate

CIS-11,14,17-EICOSATRIENOIC ACID METHYL ESTER

C21H36O2 (320.2715156)


   

methyl [1R-(1alpha,4abeta,4balpha,7beta,8abeta,10aalpha)]-tetradecahydro-7-isopropyl-1,4a-dimethylphenanthren-1-carboxylate

methyl [1R-(1alpha,4abeta,4balpha,7beta,8abeta,10aalpha)]-tetradecahydro-7-isopropyl-1,4a-dimethylphenanthren-1-carboxylate

C21H36O2 (320.2715156)


   
   

5-alpha-pregnane-3-beta,20-alpha-diol

5-alpha-pregnane-3-beta,20-alpha-diol

C21H36O2 (320.2715156)


   

(3beta,5beta)-Pregnane-3,20-diol

(3beta,5beta)-Pregnane-3,20-diol

C21H36O2 (320.2715156)


D006730 - Hormones, Hormone Substitutes, and Hormone Antagonists > D006728 - Hormones

   

5,8,11-Eicosatrienoic acid, methyl ester, (5Z,8Z,11Z)-

5,8,11-Eicosatrienoic acid, methyl ester, (5Z,8Z,11Z)-

C21H36O2 (320.2715156)


   

(8S,9S,10S,13R,14S,17S)-17-ethyl-10,13-dimethyl-1,2,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydrocyclopenta[a]phenanthrene-3,3-diol

(8S,9S,10S,13R,14S,17S)-17-ethyl-10,13-dimethyl-1,2,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydrocyclopenta[a]phenanthrene-3,3-diol

C21H36O2 (320.2715156)


   

6alpha,17-Dimethyl-5alpha-androstane-3beta,17beta-diol

6alpha,17-Dimethyl-5alpha-androstane-3beta,17beta-diol

C21H36O2 (320.2715156)


   

3,5-Dimethyl-1-hexadecylpyrazole

3,5-Dimethyl-1-hexadecylpyrazole

C21H40N2 (320.319132)


   

E6001_SIGMA

(11E,14E,17E)-icosa-11,14,17-trienoic acid methyl ester

C21H36O2 (320.2715156)


   

(7Z,10Z,13Z)-henicosa-7,10,13-trienoic acid

(7Z,10Z,13Z)-henicosa-7,10,13-trienoic acid

C21H36O2 (320.2715156)


   

Pregnane-3,20-diol, (3alpha,5beta)-

Pregnane-3,20-diol, (3alpha,5beta)-

C21H36O2 (320.2715156)


   

(9E,11E,13E)-henicosa-9,11,13-trienoic acid

(9E,11E,13E)-henicosa-9,11,13-trienoic acid

C21H36O2 (320.2715156)


   

Allopregnane-3alpha,20alpha-diol

(3R,5S,8R,9S,10S,13S,14S,17S)-17-[(1S)-1-hydroxyethyl]-10,13-dimethyl-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthren-3-ol

C21H36O2 (320.2715156)


   

Cardol

5-pentadecylbenzene-1,3-diol

C21H36O2 (320.2715156)


5-Pentadecylresorcinol (Adipostatin A) is a glycerol-3-phosphate dehydrogenase (GPDH) inhibitor with an IC50 of 4.1 μM. Adipostatin A shows good larvicidal activity against Aedes aegypti[1][2]. 5-Pentadecylresorcinol (Adipostatin A) is a glycerol-3-phosphate dehydrogenase (GPDH) inhibitor with an IC50 of 4.1 μM. Adipostatin A shows good larvicidal activity against Aedes aegypti[1][2].

   

Heneicosatrienoic acid

Heneicosatrienoic acid

C21H36O2 (320.2715156)


   

{14-methoxy-5,5,9-trimethyltetracyclo[11.2.1.0¹,¹⁰.0⁴,⁹]hexadecan-14-yl}methanol

{14-methoxy-5,5,9-trimethyltetracyclo[11.2.1.0¹,¹⁰.0⁴,⁹]hexadecan-14-yl}methanol

C21H36O2 (320.2715156)


   

(1r,4r,7r,9r,10s,13r,15s)-5,5,9,14,14-pentamethyltetracyclo[11.2.1.0¹,¹⁰.0⁴,⁹]hexadecane-7,15-diol

(1r,4r,7r,9r,10s,13r,15s)-5,5,9,14,14-pentamethyltetracyclo[11.2.1.0¹,¹⁰.0⁴,⁹]hexadecane-7,15-diol

C21H36O2 (320.2715156)


   

methyl (2e)-5-[(1s,2s,4ar,8ar)-2,5,5,8a-tetramethyl-octahydronaphthalen-1-yl]-3-methylpent-2-enoate

methyl (2e)-5-[(1s,2s,4ar,8ar)-2,5,5,8a-tetramethyl-octahydronaphthalen-1-yl]-3-methylpent-2-enoate

C21H36O2 (320.2715156)


   

methyl (8e,11e,14e)-icosa-8,11,14-trienoate

methyl (8e,11e,14e)-icosa-8,11,14-trienoate

C21H36O2 (320.2715156)


   

3β,6β,8α-triacetoxy-4β,5α:1α,10β-diepoxy-germacrane

NA

C21H36O2 (320.2715156)


{"Ingredient_id": "HBIN008100","Ingredient_name": "3\u03b2,6\u03b2,8\u03b1-triacetoxy-4\u03b2,5\u03b1:1\u03b1,10\u03b2-diepoxy-germacrane","Alias": "NA","Ingredient_formula": "C21H36O2","Ingredient_Smile": "CC12CCC(CC1CCC3C2CCC4(C3CCC4CCO)C)O","Ingredient_weight": "NA","OB_score": "NA","CAS_id": "NA","SymMap_id": "NA","TCMID_id": "21498","TCMSP_id": "NA","TCM_ID_id": "NA","PubChem_id": "NA","DrugBank_id": "NA"}

   

5alpha-pregnane-3beta,20beta-diol

5α-pregnane-3β,20β-diol

C21H36O2 (320.2715156)


{"Ingredient_id": "HBIN011434","Ingredient_name": "5alpha-pregnane-3beta,20beta-diol","Alias": "5\u03b1-pregnane-3\u03b2,20\u03b2-diol","Ingredient_formula": "C21H36O2","Ingredient_Smile": "CC(C1CCC2C1(CCC3C2CCC4C3(CCC(C4)O)C)C)O","Ingredient_weight": "320.5 g/mol","OB_score": "NA","CAS_id": "NA","SymMap_id": "NA","TCMID_id": "31839;17770","TCMSP_id": "NA","TCM_ID_id": "NA","PubChem_id": "101767","DrugBank_id": "NA"}

   

alkylresorcinol a

NA

C21H36O2 (320.2715156)


{"Ingredient_id": "HBIN015185","Ingredient_name": "alkylresorcinol a","Alias": "NA","Ingredient_formula": "C21H36O2","Ingredient_Smile": "CCCCCCCCCCCCCCCC1=CC(=CC(=C1)O)O","Ingredient_weight": "NA","OB_score": "NA","CAS_id": "NA","SymMap_id": "NA","TCMID_id": "911","TCMSP_id": "NA","TCM_ID_id": "NA","PubChem_id": "NA","DrugBank_id": "NA"}

   

2-pentadecylbenzene-1,3-diol

2-pentadecylbenzene-1,3-diol

C21H36O2 (320.2715156)


   

methyl 5-(1,2,4a,5-tetramethyl-2,3,4,7,8,8a-hexahydronaphthalen-1-yl)-3-methylpentanoate

methyl 5-(1,2,4a,5-tetramethyl-2,3,4,7,8,8a-hexahydronaphthalen-1-yl)-3-methylpentanoate

C21H36O2 (320.2715156)


   

methyl (3r)-5-[(1s,2r,4ar,8ar)-1,2,4a,5-tetramethyl-2,3,4,7,8,8a-hexahydronaphthalen-1-yl]-3-methylpentanoate

methyl (3r)-5-[(1s,2r,4ar,8ar)-1,2,4a,5-tetramethyl-2,3,4,7,8,8a-hexahydronaphthalen-1-yl]-3-methylpentanoate

C21H36O2 (320.2715156)


   

(2e)-2-[(3e,7e,10s)-4,8,10,12-tetramethyltrideca-3,7,11-trien-1-yl]but-2-ene-1,4-diol

(2e)-2-[(3e,7e,10s)-4,8,10,12-tetramethyltrideca-3,7,11-trien-1-yl]but-2-ene-1,4-diol

C21H36O2 (320.2715156)


   

methyl[2-(methylamino)ethyl][(12z,14r)-14-methylhexadec-12-en-10-yn-1-yl]amine

methyl[2-(methylamino)ethyl][(12z,14r)-14-methylhexadec-12-en-10-yn-1-yl]amine

C21H40N2 (320.319132)


   

5-(13-methyltetradecyl)benzene-1,3-diol

5-(13-methyltetradecyl)benzene-1,3-diol

C21H36O2 (320.2715156)


   

methyl (3r)-5-[(1r,2s,4ar,8as)-1,2,4a,5-tetramethyl-2,3,4,7,8,8a-hexahydronaphthalen-1-yl]-3-methylpentanoate

methyl (3r)-5-[(1r,2s,4ar,8as)-1,2,4a,5-tetramethyl-2,3,4,7,8,8a-hexahydronaphthalen-1-yl]-3-methylpentanoate

C21H36O2 (320.2715156)


   

methyl (3s)-5-[(1s,4as,8as)-2,5,5,8a-tetramethyl-1,4,4a,6,7,8-hexahydronaphthalen-1-yl]-3-methylpentanoate

methyl (3s)-5-[(1s,4as,8as)-2,5,5,8a-tetramethyl-1,4,4a,6,7,8-hexahydronaphthalen-1-yl]-3-methylpentanoate

C21H36O2 (320.2715156)


   

(12z)-heptadec-12-en-10-yn-1-yl(methyl)[2-(methylamino)ethyl]amine

(12z)-heptadec-12-en-10-yn-1-yl(methyl)[2-(methylamino)ethyl]amine

C21H40N2 (320.319132)


   

[(1s,4r,9r,10r,13r,14s)-14-methoxy-5,5,9-trimethyltetracyclo[11.2.1.0¹,¹⁰.0⁴,⁹]hexadecan-14-yl]methanol

[(1s,4r,9r,10r,13r,14s)-14-methoxy-5,5,9-trimethyltetracyclo[11.2.1.0¹,¹⁰.0⁴,⁹]hexadecan-14-yl]methanol

C21H36O2 (320.2715156)


   

(1r,2e,6s,7z,9r,12e)-6-isopropyl-9-methoxy-3,9,13-trimethylcyclotetradeca-2,7,12-trien-1-ol

(1r,2e,6s,7z,9r,12e)-6-isopropyl-9-methoxy-3,9,13-trimethylcyclotetradeca-2,7,12-trien-1-ol

C21H36O2 (320.2715156)


   

methyl icosa-2,4,6-trienoate

methyl icosa-2,4,6-trienoate

C21H36O2 (320.2715156)


   

methyl (3s)-5-[(4ar,8ar)-2,5,5,8a-tetramethyl-3,4,4a,6,7,8-hexahydronaphthalen-1-yl]-3-methylpentanoate

methyl (3s)-5-[(4ar,8ar)-2,5,5,8a-tetramethyl-3,4,4a,6,7,8-hexahydronaphthalen-1-yl]-3-methylpentanoate

C21H36O2 (320.2715156)


   

henicos-20-en-6-ynoic acid

henicos-20-en-6-ynoic acid

C21H36O2 (320.2715156)


   

methoxy[2-methyl-13-(pyridin-3-yl)tridecyl]amine

methoxy[2-methyl-13-(pyridin-3-yl)tridecyl]amine

C20H36N2O (320.2827486)


   

(2z)-2-hydroxyhenicosa-2,12,15-trien-4-one

(2z)-2-hydroxyhenicosa-2,12,15-trien-4-one

C21H36O2 (320.2715156)


   

5-[5-(methoxymethyl)-5,8a-dimethyl-2-methylidene-hexahydro-1h-naphthalen-1-yl]-3-methylpent-1-en-3-ol

5-[5-(methoxymethyl)-5,8a-dimethyl-2-methylidene-hexahydro-1h-naphthalen-1-yl]-3-methylpent-1-en-3-ol

C21H36O2 (320.2715156)


   

2-(4,8,10,12-tetramethyltrideca-3,7,11-trien-1-yl)but-2-ene-1,4-diol

2-(4,8,10,12-tetramethyltrideca-3,7,11-trien-1-yl)but-2-ene-1,4-diol

C21H36O2 (320.2715156)


   

methyl 5-(2,5,5,8a-tetramethyl-3,4,4a,6,7,8-hexahydronaphthalen-1-yl)-3-methylpentanoate

methyl 5-(2,5,5,8a-tetramethyl-3,4,4a,6,7,8-hexahydronaphthalen-1-yl)-3-methylpentanoate

C21H36O2 (320.2715156)


   

methyl 5-(2,5,5,8a-tetramethyl-1,4,4a,6,7,8-hexahydronaphthalen-1-yl)-3-methylpentanoate

methyl 5-(2,5,5,8a-tetramethyl-1,4,4a,6,7,8-hexahydronaphthalen-1-yl)-3-methylpentanoate

C21H36O2 (320.2715156)


   

(2z,12z,15z)-2-hydroxyhenicosa-2,12,15-trien-4-one

(2z,12z,15z)-2-hydroxyhenicosa-2,12,15-trien-4-one

C21H36O2 (320.2715156)


   

(3s)-5-[(1s,4ar,5s,8ar)-5-(methoxymethyl)-5,8a-dimethyl-2-methylidene-hexahydro-1h-naphthalen-1-yl]-3-methylpent-1-en-3-ol

(3s)-5-[(1s,4ar,5s,8ar)-5-(methoxymethyl)-5,8a-dimethyl-2-methylidene-hexahydro-1h-naphthalen-1-yl]-3-methylpent-1-en-3-ol

C21H36O2 (320.2715156)


   

methyl 5-(1,2,4a-trimethyl-5-methylidene-hexahydro-2h-naphthalen-1-yl)-3-methylpentanoate

methyl 5-(1,2,4a-trimethyl-5-methylidene-hexahydro-2h-naphthalen-1-yl)-3-methylpentanoate

C21H36O2 (320.2715156)


   

methyl (3r)-5-[(1r,2s,4as,8as)-1,2,4a-trimethyl-5-methylidene-hexahydro-2h-naphthalen-1-yl]-3-methylpentanoate

methyl (3r)-5-[(1r,2s,4as,8as)-1,2,4a-trimethyl-5-methylidene-hexahydro-2h-naphthalen-1-yl]-3-methylpentanoate

C21H36O2 (320.2715156)


   

methyl 5-(2,5,5,8a-tetramethyl-octahydronaphthalen-1-yl)-3-methylpent-2-enoate

methyl 5-(2,5,5,8a-tetramethyl-octahydronaphthalen-1-yl)-3-methylpent-2-enoate

C21H36O2 (320.2715156)