Exact Mass: 336.1797

Exact Mass Matches: 336.1797

Found 146 metabolites which its exact mass value is equals to given mass value 336.1797, within given mass tolerance error 0.01 dalton. Try search metabolite list with more accurate mass tolerance error 0.001 dalton.

Tabersonine

methyl(1R,12R,19S)-12-ethyl-8,16-diazapentacyclo[10.6.1.01,9.02,7.016,19]nonadeca-2,4,6,9,13-pentaene-10-carboxylate

C21H24N2O2 (336.1838)


Tabersonine is a monoterpenoid indole alkaloid with cytotoxic activity. It has a role as an antineoplastic agent and a metabolite. It is an alkaloid ester, a monoterpenoid indole alkaloid, a methyl ester and an organic heteropentacyclic compound. It is a conjugate base of a tabersoninium(1+). Tabersonine is a natural product found in Voacanga schweinfurthii, Tabernaemontana citrifolia, and other organisms with data available. A monoterpenoid indole alkaloid with cytotoxic activity. Annotation level-1 Tabersonine is an indole alkaloid mainly isolated from Catharanthus roseus. Tabersonine disrupts Aβ(1-42) aggregation and ameliorates Aβ aggregate-induced cytotoxicity. Tabersonine has anti-inflammatory activities and acts as a potential therapeutic candidate for the treatment of ALI/ARDS[1]. Tabersonine is an indole alkaloid mainly isolated from Catharanthus roseus. Tabersonine disrupts Aβ(1-42) aggregation and ameliorates Aβ aggregate-induced cytotoxicity. Tabersonine has anti-inflammatory activities and acts as a potential therapeutic candidate for the treatment of ALI/ARDS[1].

   

Apovincamine

Methyl (13aS,13bS)-13a-Ethyl-2,3,5,6,13a,13b-hexahydro-1H-indolo[3,2,1-de]pyrido[3,2,1-ij][1,5]naphthyridine-12-carboxylate (Apovincamine)

C21H24N2O2 (336.1838)


Apovincamine is an alkaloid. Apovincamine is a natural product found in Euglena gracilis with data available. C78274 - Agent Affecting Cardiovascular System > C29707 - Vasodilating Agent D000970 - Antineoplastic Agents > D014748 - Vinca Alkaloids

   

Catharanthine

methyl (1R,15R,18R)-17-ethyl-3,13-diazapentacyclo[13.3.1.02,10.04,9.013,18]nonadeca-2(10),4,6,8,16-pentaene-1-carboxylate

C21H24N2O2 (336.1838)


Catharanthine is an organic heteropentacyclic compound and monoterpenoid indole alkaloid produced by the medicinal plant Catharanthus roseus via strictosidine. It is a bridged compound, an organic heteropentacyclic compound, a methyl ester, a monoterpenoid indole alkaloid, a tertiary amino compound and an alkaloid ester. It is a conjugate base of a catharanthine(1+). Catharanthine is a natural product found in Catharanthus trichophyllus, Tabernaemontana catharinensis, and other organisms with data available. An organic heteropentacyclic compound and monoterpenoid indole alkaloid produced by the medicinal plant Catharanthus roseus via strictosidine. D000970 - Antineoplastic Agents > D014748 - Vinca Alkaloids Annotation level-1 Catharanthine is an alkaloid isolated from Catharanthus roseus, inhibits voltage-operated L-type Ca2+ channel, with anti-cancer and blood pressure-lowering activity[1]. Catharanthine is an alkaloid isolated from Catharanthus roseus, inhibits voltage-operated L-type Ca2+ channel, with anti-cancer and blood pressure-lowering activity[1].

   

4-Chloro-17alpha-methyltestosterone

4-Chloro-17alpha-methyl-17beta-hydroxy-4-androsten-3-one

C20H29ClO2 (336.1856)


   

S-Japonin

(4,4a-dimethyl-7-oxo-6-propan-2-ylidene-2,3,4,5,8,8a-hexahydro-1H-naphthalen-2-yl) (E)-3-methylsulfanylprop-2-enoate

C19H28O3S (336.1759)


Constituent of leaves of Petasites japonicus. S-Japonin is found in giant butterbur and green vegetables. S-Japonin is found in giant butterbur. S-Japonin is a constituent of leaves of Petasites japonicus

   

(+)-3,4-Didehydrocoronaridine

Methyl 17-ethyl-3,13-diazapentacyclo[13.3.1.0²,¹⁰.0⁴,⁹.0¹³,¹⁸]nonadeca-2(10),4,6,8,16-pentaene-1-carboxylic acid

C21H24N2O2 (336.1838)


   

Arphamenine B

5-amino-8-carbamimidamido-2-[(4-hydroxyphenyl)methyl]-4-oxooctanoic acid

C16H24N4O4 (336.1797)


   
   

methyl 6,7-didehydro-2,20-cycloaspidospermidine-3-carboxylate

methyl 6,7-didehydro-2,20-cycloaspidospermidine-3-carboxylate

C21H24N2O2 (336.1838)


   

16,17-Anhydrotacamine

16,17-Anhydrotacamine

C21H24N2O2 (336.1838)


   
   
   
   

12-Methoxy-Na-methylvellosimine

(+)-12-Methoxy-Na-methylvellosimine

C21H24N2O2 (336.1838)


   
   

(+)-17-O-Acetylnortetraphyllicine

(+)-17-O-Acetylnortetraphyllicine

C21H24N2O2 (336.1838)


   
   
   

Tephrowatsin B

5,7-Dimethoxy-8-prenylflav-3-ene

C22H24O3 (336.1725)


   
   
   

Sinapoylagmatine

Sinapoylagmatine

C16H24N4O4 (336.1797)


Annotation level-3

   

2,7-bis(allyloxy)-5-methoxy-3-methyl-9,10-dihydrophenanthrene

2,7-bis(allyloxy)-5-methoxy-3-methyl-9,10-dihydrophenanthrene

C22H24O3 (336.1725)


   

Oblongifoliagarcinine B

Oblongifoliagarcinine B

C22H24O3 (336.1725)


   

Isoretulinal|Retulinal

Isoretulinal|Retulinal

C21H24N2O2 (336.1838)


   

(-)-galbacin

(-)-galbacin

C22H24O3 (336.1725)


   

?酶-Tabersonine

?酶-Tabersonine

C21H24N2O2 (336.1838)


   

Vindolinine, hydrochloride

Vindolinine, hydrochloride

C21H24N2O2 (336.1838)


   

Asperrubrol (Pigment gamma)

Asperrubrol (Pigment gamma)

C22H24O3 (336.1725)


   

19,20-dihydroisostrychnine I

19,20-dihydroisostrychnine I

C21H24N2O2 (336.1838)


   

alpha-methyl-asclepobioside|beta-methyl asclepobioside

alpha-methyl-asclepobioside|beta-methyl asclepobioside

C15H28O8 (336.1784)


   

Asperrubrol

Asperrubrol

C22H24O3 (336.1725)


A methyl ester derived from (2Z,4E,6E,8E,10E,12E)-3-hydroxy-2,12-dimethyl-13-phenyltrideca-2,4,6,8,10,12-hexaenoic acid. Originally isolated from Aspergillus niger.

   

Antibiotic 8006-I

Antibiotic 8006-I

C22H24O3 (336.1725)


   

5-Acetylapocinchonamine

5-Acetylapocinchonamine

C21H24N2O2 (336.1838)


   
   

(+)-Na-methylpericyclivine|N-methylpericyclivine|vochalotine

(+)-Na-methylpericyclivine|N-methylpericyclivine|vochalotine

C21H24N2O2 (336.1838)


   

multiflorabiphenyl A

multiflorabiphenyl A

C22H24O3 (336.1725)


   

N-Methyl-16-epi-pericyclivine

N-Methyl-16-epi-pericyclivine

C21H24N2O2 (336.1838)


   

(21S)-11,12-Didehydro-21,22-dihydro-12,24-seco-strychnidin-10-on(?)|(21S)-11,12-didehydro-21,22-dihydro-12,24-seco-strychnidin-10-one(?)

(21S)-11,12-Didehydro-21,22-dihydro-12,24-seco-strychnidin-10-on(?)|(21S)-11,12-didehydro-21,22-dihydro-12,24-seco-strychnidin-10-one(?)

C21H24N2O2 (336.1838)


   

10-methoxy-1-methyl-sarpagan-17-al|Majvinine

10-methoxy-1-methyl-sarpagan-17-al|Majvinine

C21H24N2O2 (336.1838)


   

S-Japonin

4,4a-dimethyl-7-oxo-6-(propan-2-ylidene)-decahydronaphthalen-2-yl (2E)-3-(methylsulfanyl)prop-2-enoate

C19H28O3S (336.1759)


   

5,6-dehydrocoronaridine

5,6-dehydrocoronaridine

C21H24N2O2 (336.1838)


   

Epi-16--kincamin|Epi-16-[Delta14]-kincamin

Epi-16--kincamin|Epi-16-[Delta14]-kincamin

C21H24N2O2 (336.1838)


   
   
   

Dehydrosecodine

Dehydrosecodine

C21H24N2O2 (336.1838)


A member of the class of indoles that is methyl 2-(1H-indol-2-yl)prop-2-enoate in which the indole moiety has been substituted at position 3 by a 2-(5-ethylpyridin-1(2H)-yl)ethyl group. An intermediate in the biosynthesis of aspidosperma and iboga alkaloids.

   

N-Sinapoylagmatine

N-Sinapoylagmatine

C16H24N4O4 (336.1797)


   

N-Feruloyl, N-methoxyagmatine

N-Feruloyl, N-methoxyagmatine

C16H24N4O4 (336.1797)


   

Vindolinin

methyl (1R,9R,10R,12R,19S,20R)-20-methyl-8,16-diazahexacyclo[10.6.1.19,12.01,9.02,7.016,19]icosa-2,4,6,13-tetraene-10-carboxylate

C21H24N2O2 (336.1838)


Vindolinine is a monoterpenoid indole alkaloid with formula C21H24N2O2, isolated from several plant species. It has a role as a plant metabolite. It is a monoterpenoid indole alkaloid, a tertiary amino compound, a methyl ester and an organic heteropentacyclic compound. Vindolinine is a natural product found in Catharanthus lanceus, Catharanthus trichophyllus, and other organisms with data available. A monoterpenoid indole alkaloid with formula C21H24N2O2, isolated from several plant species. D000970 - Antineoplastic Agents > D014748 - Vinca Alkaloids

   

(2R,3R,4S,5S,6R)-2-[3-(2-hydroxyethyl)-4-(hydroxymethyl)hex-5-enoxy]-6-(hydroxymethyl)oxane-3,4,5-triol

NCGC00380098-01!(2R,3R,4S,5S,6R)-2-[3-(2-hydroxyethyl)-4-(hydroxymethyl)hex-5-enoxy]-6-(hydroxymethyl)oxane-3,4,5-triol

C15H28O8 (336.1784)


   

methyl (1R,18R)-17-ethyl-3,13-diazapentacyclo[13.3.1.0²,¹⁰.0⁴,⁹.0¹³,¹⁸]nonadeca-2(10),4(9),5,7,16-pentaene-1-carboxylate

methyl (1R,18R)-17-ethyl-3,13-diazapentacyclo[13.3.1.0²,¹⁰.0⁴,⁹.0¹³,¹⁸]nonadeca-2(10),4(9),5,7,16-pentaene-1-carboxylate

C21H24N2O2 (336.1838)


   
   

1-Isopropyl-4-(4-isopropylphenyl)-6-methoxy-2(1H)-quinazolinone

1-Isopropyl-4-(4-isopropylphenyl)-6-methoxy-2(1H)-quinazolinone

C21H24N2O2 (336.1838)


   

CBL-0137 free base

CBL-0137 free base

C21H24N2O2 (336.1838)


   

2-N-FMOC-AMINOMETHYL PIPERIDINE

2-N-FMOC-AMINOMETHYL PIPERIDINE

C21H24N2O2 (336.1838)


   

Thiophene-2,5-diboronic Acid Bis(pinacol) Ester

Thiophene-2,5-diboronic Acid Bis(pinacol) Ester

C16H26B2O4S (336.1738)


   

Tetraoctyliniglycol titanate

Tetraoctyliniglycol titanate

C16H32O4Ti (336.178)


   

3-N-Fmoc-Aminomethyl piperidine

3-N-Fmoc-Aminomethyl piperidine

C21H24N2O2 (336.1838)


   

TERT-BUTYL 4-(1-AMINO-3-ETHOXY-3-OXOPROPYL)PIPERIDINE-1-CARBOXYLATE HYDROCHLORIDE

TERT-BUTYL 4-(1-AMINO-3-ETHOXY-3-OXOPROPYL)PIPERIDINE-1-CARBOXYLATE HYDROCHLORIDE

C15H29ClN2O4 (336.1816)


   

4-(1-Adamantyl)piperazine dihydrochloride

4-(1-Adamantyl)piperazine dihydrochloride

C16H30Cl2N2O (336.1735)


   

5,6-bis(hexyloxy)benzo[c][1,2,5]thiadiazole

5,6-bis(hexyloxy)benzo[c][1,2,5]thiadiazole

C18H28N2O2S (336.1871)


   

{(S)-1-[Cyclopropyl-(4-fluoro-benzyl)-carbaMoyl]-ethyl}-carbaMic acid tert-butyl ester

{(S)-1-[Cyclopropyl-(4-fluoro-benzyl)-carbaMoyl]-ethyl}-carbaMic acid tert-butyl ester

C18H25FN2O3 (336.1849)


   

Diadamantan-1-ylphosphinous chloride

Diadamantan-1-ylphosphinous chloride

C20H30ClP (336.1774)


   

decyl aldehyde (dnph derivative)

decyl aldehyde (dnph derivative)

C16H24N4O4 (336.1797)


   

1-[(4-methylpiperazin-1-yl)methyl]adamantan-2-ol dihydrochloride

1-[(4-methylpiperazin-1-yl)methyl]adamantan-2-ol dihydrochloride

C16H30Cl2N2O (336.1735)


   

4-N-Fmoc-Aminomethyl piperidine

4-N-Fmoc-Aminomethyl piperidine

C21H24N2O2 (336.1838)


   

Methylclostebol

Methylclostebol

C20H29ClO2 (336.1856)


   
   

1,3-Bis(6-isocyanatohexyl)-1,3-diazetidine-2,4-dione

1,3-Bis(6-isocyanatohexyl)-1,3-diazetidine-2,4-dione

C16H24N4O4 (336.1797)


   

2-cyclopropyl-1-[4-(2-methoxyphenoxy)butyl]-1H-benzimidazole

2-cyclopropyl-1-[4-(2-methoxyphenoxy)butyl]-1H-benzimidazole

C21H24N2O2 (336.1838)


   

(3R, 7S)-12-oxojasmonoyl-isoleucine

(3R, 7S)-12-oxojasmonoyl-isoleucine

C18H26NO5- (336.1811)


   

1-(5-Bicyclo[2.2.1]hept-2-enylmethyl)-4-[3-(trifluoromethyl)phenyl]piperazine

1-(5-Bicyclo[2.2.1]hept-2-enylmethyl)-4-[3-(trifluoromethyl)phenyl]piperazine

C19H23F3N2 (336.1813)


   

N-[(2R,4S)-2-methyl-1-(1-oxopropyl)-3,4-dihydro-2H-quinolin-4-yl]-N-phenylacetamide

N-[(2R,4S)-2-methyl-1-(1-oxopropyl)-3,4-dihydro-2H-quinolin-4-yl]-N-phenylacetamide

C21H24N2O2 (336.1838)


   

1-(4-luorophenyl)-4-[(2-phenyl-1H-imidazol-5-yl)methyl]piperazine

1-(4-luorophenyl)-4-[(2-phenyl-1H-imidazol-5-yl)methyl]piperazine

C20H21FN4 (336.175)


   

Senecionine(1+)

Senecionine(1+)

C18H26NO5+ (336.1811)


An organic cation obtained by protonation of the tertiary amino group of senecionine; major structure at pH 7.3.

   

1-Dodecylglycerone 3-phosphate(2-)

1-Dodecylglycerone 3-phosphate(2-)

C15H29O6P-2 (336.1702)


   
   

(+)-3,4-Didehydrocoronaridine

(+)-3,4-Didehydrocoronaridine

C21H24N2O2 (336.1838)


   

Methyl-chlorotestosterone

Methyl-chlorotestosterone

C20H29ClO2 (336.1856)


   

(2R,3R,4S,5S,6R)-2-[3-(2-hydroxyethyl)-4-(hydroxymethyl)hex-5-enoxy]-6-(hydroxymethyl)oxane-3,4,5-triol

(2R,3R,4S,5S,6R)-2-[3-(2-hydroxyethyl)-4-(hydroxymethyl)hex-5-enoxy]-6-(hydroxymethyl)oxane-3,4,5-triol

C15H28O8 (336.1784)


   

12-Phenylazobicyclo[8.3.2]pentadeca-1(13),10-diene-14,15-dione

12-Phenylazobicyclo[8.3.2]pentadeca-1(13),10-diene-14,15-dione

C21H24N2O2 (336.1838)


   

Catharanthine hcl

Catharanthine hcl

C21H24N2O2 (336.1838)


   

1-Dodecylglycerone 3-phosphate(2-)

1-Dodecylglycerone 3-phosphate(2-)

C15H29O6P (336.1702)


A 1-alkylglycerone 3-phosphate(2-) obtained by deprotonation of the phosphate OH groups of 1-dodecylglycerone 3-phosphate; major species at pH 7.3.

   

S-15535

S-15535

C21H24N2O2 (336.1838)


S-15535 is a highly selective 5-HT1A receptor ligand. S-15535 is an antagonist of postsynaptic 5-HT1A receptors and an agonist of presynaptic 5-HT1A receptors. S-15535 can be used in research on psychiatric disorders, such as anti-anxiety[1].

   

5-[(2s,3s,4s,5s)-5-(1,3-dihydro-2-benzofuran-5-yl)-3,4-dimethyloxolan-2-yl]-1,3-dihydro-2-benzofuran

5-[(2s,3s,4s,5s)-5-(1,3-dihydro-2-benzofuran-5-yl)-3,4-dimethyloxolan-2-yl]-1,3-dihydro-2-benzofuran

C22H24O3 (336.1725)


   

(3r)-n-{[(2s,5s,6r)-6-hydroxy-5-{[(3r)-1-hydroxy-3-isocyanobutylidene]amino}oxan-2-yl]methyl}-3-isocyanobutanimidic acid

(3r)-n-{[(2s,5s,6r)-6-hydroxy-5-{[(3r)-1-hydroxy-3-isocyanobutylidene]amino}oxan-2-yl]methyl}-3-isocyanobutanimidic acid

C16H24N4O4 (336.1797)


   

methyl (1s,9r,16s,18r,21s)-2,12-diazahexacyclo[14.2.2.1⁹,¹².0¹,⁹.0³,⁸.0¹⁶,²¹]henicosa-3,5,7,14-tetraene-18-carboxylate

methyl (1s,9r,16s,18r,21s)-2,12-diazahexacyclo[14.2.2.1⁹,¹².0¹,⁹.0³,⁸.0¹⁶,²¹]henicosa-3,5,7,14-tetraene-18-carboxylate

C21H24N2O2 (336.1838)


   

1-[(1r,12r,13s,18r)-3,20-dimethyl-15-oxa-3,20-diazapentacyclo[10.7.1.0²,¹⁰.0⁴,⁹.0¹³,¹⁸]icosa-2(10),4,6,8,16-pentaen-17-yl]ethanone

1-[(1r,12r,13s,18r)-3,20-dimethyl-15-oxa-3,20-diazapentacyclo[10.7.1.0²,¹⁰.0⁴,⁹.0¹³,¹⁸]icosa-2(10),4,6,8,16-pentaen-17-yl]ethanone

C21H24N2O2 (336.1838)


   

(1s,12s,13r,14s,15e)-15-ethylidene-5-methoxy-3-methyl-3,17-diazapentacyclo[12.3.1.0²,¹⁰.0⁴,⁹.0¹²,¹⁷]octadeca-2(10),4,6,8-tetraene-13-carbaldehyde

(1s,12s,13r,14s,15e)-15-ethylidene-5-methoxy-3-methyl-3,17-diazapentacyclo[12.3.1.0²,¹⁰.0⁴,⁹.0¹²,¹⁷]octadeca-2(10),4,6,8-tetraene-13-carbaldehyde

C21H24N2O2 (336.1838)


   

(3e,5e,7e,9e,11e,13e,15e,17e,19e)-21-oxodocosa-3,5,7,9,11,13,15,17,19-nonaenoic acid

(3e,5e,7e,9e,11e,13e,15e,17e,19e)-21-oxodocosa-3,5,7,9,11,13,15,17,19-nonaenoic acid

C22H24O3 (336.1725)


   

(2r,5s)-5-amino-8-carbamimidamido-2-[(4-hydroxyphenyl)methyl]-4-oxooctanoic acid

(2r,5s)-5-amino-8-carbamimidamido-2-[(4-hydroxyphenyl)methyl]-4-oxooctanoic acid

C16H24N4O4 (336.1797)


   

methyl (1s,12s,13r,14r,15e)-15-ethylidene-3-methyl-3,17-diazapentacyclo[12.3.1.0²,¹⁰.0⁴,⁹.0¹²,¹⁷]octadeca-2(10),4,6,8-tetraene-13-carboxylate

methyl (1s,12s,13r,14r,15e)-15-ethylidene-3-methyl-3,17-diazapentacyclo[12.3.1.0²,¹⁰.0⁴,⁹.0¹²,¹⁷]octadeca-2(10),4,6,8-tetraene-13-carboxylate

C21H24N2O2 (336.1838)


   

2-{2-[(4s,5s)-5-ethenyl-1-azabicyclo[2.2.2]oct-2-en-2-yl]-1h-indol-3-yl}ethyl acetate

2-{2-[(4s,5s)-5-ethenyl-1-azabicyclo[2.2.2]oct-2-en-2-yl]-1h-indol-3-yl}ethyl acetate

C21H24N2O2 (336.1838)


   

(12s,13r,18r)-3,16,20-trimethyl-15-oxa-3,20-diazapentacyclo[10.7.1.0²,¹⁰.0⁴,⁹.0¹³,¹⁸]icosa-2(10),4,6,8,16-pentaene-17-carbaldehyde

(12s,13r,18r)-3,16,20-trimethyl-15-oxa-3,20-diazapentacyclo[10.7.1.0²,¹⁰.0⁴,⁹.0¹³,¹⁸]icosa-2(10),4,6,8,16-pentaene-17-carbaldehyde

C21H24N2O2 (336.1838)


   

6-[4-hydroxy-3-(3-methylbut-2-en-1-yl)phenyl]-2,2-dimethylchromen-8-ol

6-[4-hydroxy-3-(3-methylbut-2-en-1-yl)phenyl]-2,2-dimethylchromen-8-ol

C22H24O3 (336.1725)


   

12-methoxy-na-methyl-vellosimine

NA

C21H24N2O2 (336.1838)


{"Ingredient_id": "HBIN000899","Ingredient_name": "12-methoxy-na-methyl-vellosimine","Alias": "NA","Ingredient_formula": "C21H24N2O2","Ingredient_Smile": "CC=C1CN2C3CC1C(C2CC4=C3N(C5=C4C=CC=C5OC)C)C=O","Ingredient_weight": "NA","OB_score": "NA","CAS_id": "NA","SymMap_id": "NA","TCMID_id": "14032","TCMSP_id": "NA","TCM_ID_id": "NA","PubChem_id": "NA","DrugBank_id": "NA"}

   

alstonerinal

NA

C21H24N2O2 (336.1838)


{"Ingredient_id": "HBIN015768","Ingredient_name": "alstonerinal","Alias": "NA","Ingredient_formula": "C21H24N2O2","Ingredient_Smile": "CC1=C(C2CC3C4=C(CC(C2CO1)N3C)C5=CC=CC=C5N4C)C=O","Ingredient_weight": "336.4 g/mol","OB_score": "NA","CAS_id": "NA","SymMap_id": "NA","TCMID_id": "999","TCMSP_id": "NA","TCM_ID_id": "NA","PubChem_id": "100983076","DrugBank_id": "NA"}

   

alstonerinal ii*

NA

C21H24N2O2 (336.1838)


{"Ingredient_id": "HBIN015769","Ingredient_name": "alstonerinal ii*","Alias": "NA","Ingredient_formula": "C21H24N2O2","Ingredient_Smile": "CC1=C(C2CC3C4=C(CC(C2CO1)N3C)C5=CC=CC=C5N4C)C=O","Ingredient_weight": "NA","OB_score": "NA","CAS_id": "NA","SymMap_id": "NA","TCMID_id": "1000","TCMSP_id": "NA","TCM_ID_id": "NA","PubChem_id": "NA","DrugBank_id": "NA"}

   

alstonerine

NA

C21H24N2O2 (336.1838)


{"Ingredient_id": "HBIN015770","Ingredient_name": "alstonerine","Alias": "NA","Ingredient_formula": "C21H24N2O2","Ingredient_Smile": "CC(=O)C1=COCC2C1CC3C4=C(CC2N3C)C5=CC=CC=C5N4C","Ingredient_weight": "336.4 g/mol","OB_score": "NA","CAS_id": "NA","SymMap_id": "NA","TCMID_id": "1001","TCMSP_id": "NA","TCM_ID_id": "NA","PubChem_id": "101306910","DrugBank_id": "NA"}

   

methyl (2z,4e,6e,8e,10e,12e)-3-hydroxy-2,8-dimethyl-13-phenyltrideca-2,4,6,8,10,12-hexaenoate

methyl (2z,4e,6e,8e,10e,12e)-3-hydroxy-2,8-dimethyl-13-phenyltrideca-2,4,6,8,10,12-hexaenoate

C22H24O3 (336.1725)


   

(2s,5r)-5-amino-8-carbamimidamido-2-[(4-hydroxyphenyl)methyl]-4-oxooctanoic acid

(2s,5r)-5-amino-8-carbamimidamido-2-[(4-hydroxyphenyl)methyl]-4-oxooctanoic acid

C16H24N4O4 (336.1797)


   

methyl (1r,4s,12s,13r,20r)-5,16-diazahexacyclo[11.6.1.1¹,⁴.0⁴,¹².0⁶,¹¹.0¹⁶,²⁰]henicosa-2,6,8,10-tetraene-3-carboxylate

methyl (1r,4s,12s,13r,20r)-5,16-diazahexacyclo[11.6.1.1¹,⁴.0⁴,¹².0⁶,¹¹.0¹⁶,²⁰]henicosa-2,6,8,10-tetraene-3-carboxylate

C21H24N2O2 (336.1838)


   

(12z)-8-acetyl-12-ethylidene-8,14-diazapentacyclo[9.5.2.0¹,⁹.0²,⁷.0¹⁴,¹⁷]octadeca-2,4,6-triene-10-carbaldehyde

(12z)-8-acetyl-12-ethylidene-8,14-diazapentacyclo[9.5.2.0¹,⁹.0²,⁷.0¹⁴,¹⁷]octadeca-2,4,6-triene-10-carbaldehyde

C21H24N2O2 (336.1838)


   

methyl (1s,9s,10r,12s,19r,20s)-20-methyl-8,16-diazahexacyclo[10.6.1.1⁹,¹².0¹,⁹.0²,⁷.0¹⁶,¹⁹]icosa-2,4,6,13-tetraene-10-carboxylate

methyl (1s,9s,10r,12s,19r,20s)-20-methyl-8,16-diazahexacyclo[10.6.1.1⁹,¹².0¹,⁹.0²,⁷.0¹⁶,¹⁹]icosa-2,4,6,13-tetraene-10-carboxylate

C21H24N2O2 (336.1838)


   

21-oxodocosa-3,5,7,9,11,13,15,17,19-nonaenoic acid

21-oxodocosa-3,5,7,9,11,13,15,17,19-nonaenoic acid

C22H24O3 (336.1725)


   

8-acetyl-12-ethylidene-8,14-diazapentacyclo[9.5.2.0¹,⁹.0²,⁷.0¹⁴,¹⁷]octadeca-2,4,6-triene-10-carbaldehyde

8-acetyl-12-ethylidene-8,14-diazapentacyclo[9.5.2.0¹,⁹.0²,⁷.0¹⁴,¹⁷]octadeca-2,4,6-triene-10-carbaldehyde

C21H24N2O2 (336.1838)


   

methyl (1r,9r,10s,11r,12s,19s,20s)-20-methyl-8,16-diazahexacyclo[10.6.1.1⁹,¹¹.0¹,⁹.0²,⁷.0¹⁶,¹⁹]icosa-2,4,6,13-tetraene-10-carboxylate

methyl (1r,9r,10s,11r,12s,19s,20s)-20-methyl-8,16-diazahexacyclo[10.6.1.1⁹,¹¹.0¹,⁹.0²,⁷.0¹⁶,¹⁹]icosa-2,4,6,13-tetraene-10-carboxylate

C21H24N2O2 (336.1838)


   

methyl (1r,12s,19s)-12-ethyl-8,16-diazapentacyclo[10.6.1.0¹,⁹.0²,⁷.0¹⁶,¹⁹]nonadeca-2,4,6,9,13-pentaene-10-carboxylate

methyl (1r,12s,19s)-12-ethyl-8,16-diazapentacyclo[10.6.1.0¹,⁹.0²,⁷.0¹⁶,¹⁹]nonadeca-2,4,6,9,13-pentaene-10-carboxylate

C21H24N2O2 (336.1838)


   

5-[5-(1,3-dihydro-2-benzofuran-5-yl)-3,4-dimethyloxolan-2-yl]-1,3-dihydro-2-benzofuran

5-[5-(1,3-dihydro-2-benzofuran-5-yl)-3,4-dimethyloxolan-2-yl]-1,3-dihydro-2-benzofuran

C22H24O3 (336.1725)


   

methyl (13r,15r,19r)-13-ethyl-1,11-diazapentacyclo[9.6.2.0²,⁷.0⁸,¹⁸.0¹⁵,¹⁹]nonadeca-2,4,6,8(18),16-pentaene-17-carboxylate

methyl (13r,15r,19r)-13-ethyl-1,11-diazapentacyclo[9.6.2.0²,⁷.0⁸,¹⁸.0¹⁵,¹⁹]nonadeca-2,4,6,8(18),16-pentaene-17-carboxylate

C21H24N2O2 (336.1838)


   

methyl (1r,9r,10r,12r,19s,20s)-20-methyl-8,16-diazahexacyclo[10.6.1.1⁹,¹².0¹,⁹.0²,⁷.0¹⁶,¹⁹]icosa-2,4,6,13-tetraene-10-carboxylate

methyl (1r,9r,10r,12r,19s,20s)-20-methyl-8,16-diazahexacyclo[10.6.1.1⁹,¹².0¹,⁹.0²,⁷.0¹⁶,¹⁹]icosa-2,4,6,13-tetraene-10-carboxylate

C21H24N2O2 (336.1838)


   

(9r,12r,13z,16s,17s)-13-ethylidene-6-methoxy-8-methyl-8,15-diazahexacyclo[14.2.1.0¹,⁹.0²,⁷.0¹⁰,¹⁵.0¹²,¹⁷]nonadeca-2,4,6-trien-18-one

(9r,12r,13z,16s,17s)-13-ethylidene-6-methoxy-8-methyl-8,15-diazahexacyclo[14.2.1.0¹,⁹.0²,⁷.0¹⁰,¹⁵.0¹²,¹⁷]nonadeca-2,4,6-trien-18-one

C21H24N2O2 (336.1838)


   

4,4a-dimethyl-7-oxo-6-(propan-2-ylidene)-hexahydro-1h-naphthalen-2-yl 3-(methylsulfanyl)prop-2-enoate

4,4a-dimethyl-7-oxo-6-(propan-2-ylidene)-hexahydro-1h-naphthalen-2-yl 3-(methylsulfanyl)prop-2-enoate

C19H28O3S (336.1759)


   

methyl (1r,9r,16r,18s,21s)-2,12-diazahexacyclo[14.2.2.1⁹,¹².0¹,⁹.0³,⁸.0¹⁶,²¹]henicosa-3,5,7,14-tetraene-18-carboxylate

methyl (1r,9r,16r,18s,21s)-2,12-diazahexacyclo[14.2.2.1⁹,¹².0¹,⁹.0³,⁸.0¹⁶,²¹]henicosa-3,5,7,14-tetraene-18-carboxylate

C21H24N2O2 (336.1838)


   

1-methyl-4-[(2s)-6-methylhept-5-en-2-yl]phenazine-2,3-diol

1-methyl-4-[(2s)-6-methylhept-5-en-2-yl]phenazine-2,3-diol

C21H24N2O2 (336.1838)


   

(12s,13r,14s,15e)-15-ethylidene-5-methoxy-3-methyl-3,17-diazapentacyclo[12.3.1.0²,¹⁰.0⁴,⁹.0¹²,¹⁷]octadeca-2(10),4,6,8-tetraene-13-carbaldehyde

(12s,13r,14s,15e)-15-ethylidene-5-methoxy-3-methyl-3,17-diazapentacyclo[12.3.1.0²,¹⁰.0⁴,⁹.0¹²,¹⁷]octadeca-2(10),4,6,8-tetraene-13-carbaldehyde

C21H24N2O2 (336.1838)


   

methyl (1r,9r,10r,12r,19s,20r)-20-methyl-8,16-diazahexacyclo[10.6.1.1⁹,¹².0¹,⁹.0²,⁷.0¹⁶,¹⁹]icosa-2,4,6,13-tetraene-10-carboxylate

methyl (1r,9r,10r,12r,19s,20r)-20-methyl-8,16-diazahexacyclo[10.6.1.1⁹,¹².0¹,⁹.0²,⁷.0¹⁶,¹⁹]icosa-2,4,6,13-tetraene-10-carboxylate

C21H24N2O2 (336.1838)


   

1-[(1r,12r,13r,18r)-3,20-dimethyl-15-oxa-3,20-diazapentacyclo[10.7.1.0²,¹⁰.0⁴,⁹.0¹³,¹⁸]icosa-2(10),4,6,8,16-pentaen-17-yl]ethanone

1-[(1r,12r,13r,18r)-3,20-dimethyl-15-oxa-3,20-diazapentacyclo[10.7.1.0²,¹⁰.0⁴,⁹.0¹³,¹⁸]icosa-2(10),4,6,8,16-pentaen-17-yl]ethanone

C21H24N2O2 (336.1838)


   

methyl (1r,15r)-17-ethyl-3,13-diazapentacyclo[13.3.1.0²,¹⁰.0⁴,⁹.0¹³,¹⁸]nonadeca-2(10),4,6,8,16-pentaene-1-carboxylate

methyl (1r,15r)-17-ethyl-3,13-diazapentacyclo[13.3.1.0²,¹⁰.0⁴,⁹.0¹³,¹⁸]nonadeca-2(10),4,6,8,16-pentaene-1-carboxylate

C21H24N2O2 (336.1838)


   

5,7-dimethoxy-8-(3-methylbut-2-en-1-yl)-2-phenyl-2h-chromene

5,7-dimethoxy-8-(3-methylbut-2-en-1-yl)-2-phenyl-2h-chromene

C22H24O3 (336.1725)


   

methyl (9s,10r,12s,19s,20s)-20-methyl-8,16-diazahexacyclo[10.6.1.1⁹,¹².0¹,⁹.0²,⁷.0¹⁶,¹⁹]icosa-2,4,6,13-tetraene-10-carboxylate

methyl (9s,10r,12s,19s,20s)-20-methyl-8,16-diazahexacyclo[10.6.1.1⁹,¹².0¹,⁹.0²,⁷.0¹⁶,¹⁹]icosa-2,4,6,13-tetraene-10-carboxylate

C21H24N2O2 (336.1838)


   

(1r,9s,10s,11r,12e,17s)-8-acetyl-12-ethylidene-8,14-diazapentacyclo[9.5.2.0¹,⁹.0²,⁷.0¹⁴,¹⁷]octadeca-2,4,6-triene-10-carbaldehyde

(1r,9s,10s,11r,12e,17s)-8-acetyl-12-ethylidene-8,14-diazapentacyclo[9.5.2.0¹,⁹.0²,⁷.0¹⁴,¹⁷]octadeca-2,4,6-triene-10-carbaldehyde

C21H24N2O2 (336.1838)


   

methyl (1r,9s,10r,12s,19s,20s)-20-methyl-8,16-diazahexacyclo[10.6.1.1⁹,¹².0¹,⁹.0²,⁷.0¹⁶,¹⁹]icosa-2,4,6,13-tetraene-10-carboxylate

methyl (1r,9s,10r,12s,19s,20s)-20-methyl-8,16-diazahexacyclo[10.6.1.1⁹,¹².0¹,⁹.0²,⁷.0¹⁶,¹⁹]icosa-2,4,6,13-tetraene-10-carboxylate

C21H24N2O2 (336.1838)


   

methyl (1r,9r,16r,18r,21s)-2,12-diazahexacyclo[14.2.2.1⁹,¹².0¹,⁹.0³,⁸.0¹⁶,²¹]henicosa-3,5,7,14-tetraene-18-carboxylate

methyl (1r,9r,16r,18r,21s)-2,12-diazahexacyclo[14.2.2.1⁹,¹².0¹,⁹.0³,⁸.0¹⁶,²¹]henicosa-3,5,7,14-tetraene-18-carboxylate

C21H24N2O2 (336.1838)


   

1-[(12s,13r,18r)-3,20-dimethyl-15-oxa-3,20-diazapentacyclo[10.7.1.0²,¹⁰.0⁴,⁹.0¹³,¹⁸]icosa-2(10),4,6,8,16-pentaen-17-yl]ethanone

1-[(12s,13r,18r)-3,20-dimethyl-15-oxa-3,20-diazapentacyclo[10.7.1.0²,¹⁰.0⁴,⁹.0¹³,¹⁸]icosa-2(10),4,6,8,16-pentaen-17-yl]ethanone

C21H24N2O2 (336.1838)


   

methyl 15-ethylidene-3-methyl-3,17-diazapentacyclo[12.3.1.0²,¹⁰.0⁴,⁹.0¹²,¹⁷]octadeca-2(10),4,6,8-tetraene-13-carboxylate

methyl 15-ethylidene-3-methyl-3,17-diazapentacyclo[12.3.1.0²,¹⁰.0⁴,⁹.0¹²,¹⁷]octadeca-2(10),4,6,8-tetraene-13-carboxylate

C21H24N2O2 (336.1838)


   

(1r,9r,10s,12r,13e,16s,17s)-13-ethylidene-6-methoxy-8-methyl-8,15-diazahexacyclo[14.2.1.0¹,⁹.0²,⁷.0¹⁰,¹⁵.0¹²,¹⁷]nonadeca-2,4,6-trien-18-one

(1r,9r,10s,12r,13e,16s,17s)-13-ethylidene-6-methoxy-8-methyl-8,15-diazahexacyclo[14.2.1.0¹,⁹.0²,⁷.0¹⁰,¹⁵.0¹²,¹⁷]nonadeca-2,4,6-trien-18-one

C21H24N2O2 (336.1838)


   

(1r,2r,4ar,9as)-2-ethenyl-8-[(hydroxymethylidene)amino]-1-isocyano-2,10,10-trimethyl-3,4,4a,9a-tetrahydro-1h-anthracen-9-one

(1r,2r,4ar,9as)-2-ethenyl-8-[(hydroxymethylidene)amino]-1-isocyano-2,10,10-trimethyl-3,4,4a,9a-tetrahydro-1h-anthracen-9-one

C21H24N2O2 (336.1838)


   

(1r,13s,14s,19s,21s)-14-(2-hydroxyethyl)-8,16-diazahexacyclo[11.5.2.1¹,⁸.0²,⁷.0¹⁶,¹⁹.0¹²,²¹]henicosa-2,4,6,11-tetraen-9-one

(1r,13s,14s,19s,21s)-14-(2-hydroxyethyl)-8,16-diazahexacyclo[11.5.2.1¹,⁸.0²,⁷.0¹⁶,¹⁹.0¹²,²¹]henicosa-2,4,6,11-tetraen-9-one

C21H24N2O2 (336.1838)


   

methyl 3-hydroxy-2,8-dimethyl-13-phenyltrideca-2,4,6,8,10,12-hexaenoate

methyl 3-hydroxy-2,8-dimethyl-13-phenyltrideca-2,4,6,8,10,12-hexaenoate

C22H24O3 (336.1725)


   

methyl 20-methyl-8,16-diazahexacyclo[10.6.1.1⁹,¹².0¹,⁹.0²,⁷.0¹⁶,¹⁹]icosa-2,4,6,13-tetraene-10-carboxylate

methyl 20-methyl-8,16-diazahexacyclo[10.6.1.1⁹,¹².0¹,⁹.0²,⁷.0¹⁶,¹⁹]icosa-2,4,6,13-tetraene-10-carboxylate

C21H24N2O2 (336.1838)


   

1-{3,20-dimethyl-15-oxa-3,20-diazapentacyclo[10.7.1.0²,¹⁰.0⁴,⁹.0¹³,¹⁸]icosa-2(10),4,6,8,16-pentaen-17-yl}ethanone

1-{3,20-dimethyl-15-oxa-3,20-diazapentacyclo[10.7.1.0²,¹⁰.0⁴,⁹.0¹³,¹⁸]icosa-2(10),4,6,8,16-pentaen-17-yl}ethanone

C21H24N2O2 (336.1838)


   

20-ethyl-10-hydroxy-8,16-diazahexacyclo[11.5.2.1¹,⁸.0²,⁷.0¹⁶,¹⁹.0¹²,²¹]henicosa-2,4,6,12(21)-tetraen-9-one

20-ethyl-10-hydroxy-8,16-diazahexacyclo[11.5.2.1¹,⁸.0²,⁷.0¹⁶,¹⁹.0¹²,²¹]henicosa-2,4,6,12(21)-tetraen-9-one

C21H24N2O2 (336.1838)


   

5-methoxy-3-methyl-2,7-bis(prop-2-en-1-yloxy)-9,10-dihydrophenanthrene

5-methoxy-3-methyl-2,7-bis(prop-2-en-1-yloxy)-9,10-dihydrophenanthrene

C22H24O3 (336.1725)


   

14-(2-hydroxyethyl)-8,16-diazahexacyclo[11.5.2.1¹,⁸.0²,⁷.0¹⁶,¹⁹.0¹²,²¹]henicosa-2,4,6,11-tetraen-9-one

14-(2-hydroxyethyl)-8,16-diazahexacyclo[11.5.2.1¹,⁸.0²,⁷.0¹⁶,¹⁹.0¹²,²¹]henicosa-2,4,6,11-tetraen-9-one

C21H24N2O2 (336.1838)


   

methyl 2,12-diazahexacyclo[14.2.2.1⁹,¹².0¹,⁹.0³,⁸.0¹⁶,²¹]henicosa-3,5,7,14-tetraene-18-carboxylate

methyl 2,12-diazahexacyclo[14.2.2.1⁹,¹².0¹,⁹.0³,⁸.0¹⁶,²¹]henicosa-3,5,7,14-tetraene-18-carboxylate

C21H24N2O2 (336.1838)


   

3,16,20-trimethyl-15-oxa-3,20-diazapentacyclo[10.7.1.0²,¹⁰.0⁴,⁹.0¹³,¹⁸]icosa-2(10),4,6,8,16-pentaene-17-carbaldehyde

3,16,20-trimethyl-15-oxa-3,20-diazapentacyclo[10.7.1.0²,¹⁰.0⁴,⁹.0¹³,¹⁸]icosa-2(10),4,6,8,16-pentaene-17-carbaldehyde

C21H24N2O2 (336.1838)


   

(1s,12s,13r,18r)-3,16,20-trimethyl-15-oxa-3,20-diazapentacyclo[10.7.1.0²,¹⁰.0⁴,⁹.0¹³,¹⁸]icosa-2(10),4,6,8,16-pentaene-17-carbaldehyde

(1s,12s,13r,18r)-3,16,20-trimethyl-15-oxa-3,20-diazapentacyclo[10.7.1.0²,¹⁰.0⁴,⁹.0¹³,¹⁸]icosa-2(10),4,6,8,16-pentaene-17-carbaldehyde

C21H24N2O2 (336.1838)


   

(2r,4s,4ar,8ar)-4,4a-dimethyl-7-oxo-6-(propan-2-ylidene)-hexahydro-1h-naphthalen-2-yl (2z)-3-(methylsulfanyl)prop-2-enoate

(2r,4s,4ar,8ar)-4,4a-dimethyl-7-oxo-6-(propan-2-ylidene)-hexahydro-1h-naphthalen-2-yl (2z)-3-(methylsulfanyl)prop-2-enoate

C19H28O3S (336.1759)


   

2-(2-{5-ethenyl-1-azabicyclo[2.2.2]oct-2-en-2-yl}-1h-indol-3-yl)ethyl acetate

2-(2-{5-ethenyl-1-azabicyclo[2.2.2]oct-2-en-2-yl}-1h-indol-3-yl)ethyl acetate

C21H24N2O2 (336.1838)


   

methyl 12-ethyl-8,16-diazapentacyclo[10.6.1.0¹,⁹.0²,⁷.0¹⁶,¹⁹]nonadeca-2,4,6,9,13-pentaene-10-carboxylate

methyl 12-ethyl-8,16-diazapentacyclo[10.6.1.0¹,⁹.0²,⁷.0¹⁶,¹⁹]nonadeca-2,4,6,9,13-pentaene-10-carboxylate

C21H24N2O2 (336.1838)


   

(1r,10s)-5-methoxy-4-(3-methylbut-2-en-1-yl)-17-oxatetracyclo[8.7.0.0²,⁷.0¹¹,¹⁶]heptadeca-2(7),3,5,11,13,15-hexaen-14-ol

(1r,10s)-5-methoxy-4-(3-methylbut-2-en-1-yl)-17-oxatetracyclo[8.7.0.0²,⁷.0¹¹,¹⁶]heptadeca-2(7),3,5,11,13,15-hexaen-14-ol

C22H24O3 (336.1725)


   

1-[(1s,12s,13r,18r)-3,20-dimethyl-15-oxa-3,20-diazapentacyclo[10.7.1.0²,¹⁰.0⁴,⁹.0¹³,¹⁸]icosa-2(10),4,6,8,16-pentaen-17-yl]ethanone

1-[(1s,12s,13r,18r)-3,20-dimethyl-15-oxa-3,20-diazapentacyclo[10.7.1.0²,¹⁰.0⁴,⁹.0¹³,¹⁸]icosa-2(10),4,6,8,16-pentaen-17-yl]ethanone

C21H24N2O2 (336.1838)


   

methyl (2e,4e,6e,8e,10e,12e)-13-(4-hydroxy-3,5-dimethylphenyl)trideca-2,4,6,8,10,12-hexaenoate

methyl (2e,4e,6e,8e,10e,12e)-13-(4-hydroxy-3,5-dimethylphenyl)trideca-2,4,6,8,10,12-hexaenoate

C22H24O3 (336.1725)


   

methyl (1s,9s,16s,18r,21r)-2,12-diazahexacyclo[14.2.2.1⁹,¹².0¹,⁹.0³,⁸.0¹⁶,²¹]henicosa-3,5,7,14-tetraene-18-carboxylate

methyl (1s,9s,16s,18r,21r)-2,12-diazahexacyclo[14.2.2.1⁹,¹².0¹,⁹.0³,⁸.0¹⁶,²¹]henicosa-3,5,7,14-tetraene-18-carboxylate

C21H24N2O2 (336.1838)