Exact Mass: 322.1681

Exact Mass Matches: 322.1681

Found 157 metabolites which its exact mass value is equals to given mass value 322.1681, within given mass tolerance error 0.001 dalton. Try search metabolite list with more accurate mass tolerance error 0.0002 dalton.

Gelsemin

CID 5462429

C20H22N2O2 (322.1681)

Gelsemine, an alkaloid from the Chinese herb Gelsemium elegans, is effective in mitigating chronic pain. Antinociceptive effects. Gelsemine, an alkaloid from the Chinese herb Gelsemium elegans, is effective in mitigating chronic pain. Antinociceptive effects.

akuammicine

(19E)-2,16,19-20-Tetradehydrocuran-17-oic acid methyl ester

C20H22N2O2 (322.1681)

A monoterpenoid indole alkaloid with formula C20H22N2O2, isolated from several plant species including Alstonia spatulata, Catharanthus roseus and Vinca major.

Gardneral

C20H22N2O2 (322.1681)

Quinidinone

6-Methoxycinchonan-9-one

C20H22N2O2 (322.1681)

Gelsemine

Spiro[3,5,8-ethanylylidene-1H-pyrano[3,4-c]pyridine-10,3-[3H]indol]-2(1H)-one, 5-ethenyl-3,4,4a,5,6,7,8,8a-octahydro-7-methyl-, [3R-(3.alpha.,4a.beta.,5.alpha.,8.alpha.,8a.beta.,9S*,10S*)]-

C20H22N2O2 (322.1681)

Gelsemin is an indole alkaloid. Gelsemine is a natural product found in Gelsemium sempervirens and Gelsemium elegans with data available. Gelsemine, an alkaloid from the Chinese herb Gelsemium elegans, is effective in mitigating chronic pain. Antinociceptive effects. Gelsemine, an alkaloid from the Chinese herb Gelsemium elegans, is effective in mitigating chronic pain. Antinociceptive effects.

Apovincaminic acid

(15S,19S)-3,4,5,6-Tetradeuterio-15-ethyl-1,11-diazapentacyclo[9.6.2.02,7.08,18.015,19]nonadeca-2,4,6,8(18),16-pentaene-17-carboxylic acid

C20H22N2O2 (322.1681)

3-((Dimethylamino)methyl)-6-methoxy-2-methyl-4-phenylisoquinolin-1(2H)-one

3-[(dimethylamino)methyl]-6-methoxy-2-methyl-4-phenyl-1,2-dihydroisoquinolin-1-one

C20H22N2O2 (322.1681)

Gelsemin

2-ethenyl-4-methyl-1,2-dihydro-9-oxa-4-azaspiro[indole-3,7-tetracyclo[6.3.1.0²,⁶.0⁵,¹¹]dodecane]-2-one

C20H22N2O2 (322.1681)

Condylocarpine

C20H22N2O2 (322.1681)

Strictamine

C20H22N2O2 (322.1681)

Pericyclivine

Sarpagan-17-oic acid, methyl ester, (16S)-

C20H22N2O2 (322.1681)

12-Methoxy-vellosimine

C20H22N2O2 (322.1681)

Pleiocarpamine

C20H22N2O2 (322.1681)

Mitoridine

(1R,9R,10S,12R,13E,16S,17S)-13-ethylidene-6-hydroxy-8-methyl-8,15-diazahexacyclo[14.2.1.01,9.02,7.010,15.012,17]nonadeca-2(7),3,5-trien-18-one

C20H22N2O2 (322.1681)

MCULE-3875253942

C20H22N2O2 (322.1681)

(+)-Schizogaline

C20H22N2O2 (322.1681)

Norpurpeline

N-Demethylpurpeline

C20H22N2O2 (322.1681)

Annotation level-1

Strychnopivotine

C20H22N2O2 (322.1681)

Gelsemine

(2S,3S,5S,6S,11S)-2-ethenyl-4-methylspiro[1H-indole-3,7-9-oxa-4-azatetracyclo[6.3.1.02,6.05,11]dodecane]-2-one

C20H22N2O2 (322.1681)

CONFIDENCE Reference Standard (Level 1); INTERNAL_ID 2295 Annotation level-1 Gelsemine, an alkaloid from the Chinese herb Gelsemium elegans, is effective in mitigating chronic pain. Antinociceptive effects. Gelsemine, an alkaloid from the Chinese herb Gelsemium elegans, is effective in mitigating chronic pain. Antinociceptive effects.

5-formylrhazinilam|rhazinal

C20H22N2O2 (322.1681)

flabelliformide A|rel-(4R,4aR,13aS)-4-ethyl-3,4,4a,5,7,13a-hexahydro-2-methyl-1H-pyrido[3,4:5,6]cyclooct[1,2-b]indole-1,6(2H)-dione

C20H22N2O2 (322.1681)

10-methoxy-sarpagan-17-al|10-Methoxy-vellosimin

C20H22N2O2 (322.1681)

Decarboomethoxyapocuanzine|demethoxycarbonyl-apocuanzine|ent-17beta,21-epoxy-12-methoxy-eburnamenine

C20H22N2O2 (322.1681)

N(1)-formyl-14,15-didehydro-12-hydroxyaspidofractinine

C20H22N2O2 (322.1681)

N(4)-Demethylalstonerine

C20H22N2O2 (322.1681)

N-[2-(2,2-Dimethyl-2H-1-benzopyran-6-yl)ethyl]-N-methylpyridine-3-carboxamide

C20H22N2O2 (322.1681)

Venalstonine

C20H22N2O2 (322.1681)

(7RS)-5-{(RS)-[(7RS)-6,7-dihydro-7-methyl-5H-cyclopenta[c]pyridin-4-yl]hydroxymethyl}-6,7-dihydro-7-methyl-5H-cyclopenta[c]pyridine-4-carbaldehyde|argutane A

C20H22N2O2 (322.1681)

Angustimicine

C20H22N2O2 (322.1681)

(1E,3aS,12bS,13aS)-1-ethylidene-1,2,6,7,12,12b,13,13a-octahydro-3a-methylfuro[2,3-g]indolo[2,3-a]quinolizin-4(3aH)-one|Latifoliamide A

C20H22N2O2 (322.1681)

12-hydroxynorfluorocurarine

C20H22N2O2 (322.1681)

Amerovolficine

C20H22N2O2 (322.1681)

(+/-)-Norpurpeline

C20H22N2O2 (322.1681)

CN1C2=CC=CC=C2C(C2)=C1C1CC3C(=CC)C(=O)OCC3C2N1

C20H22N2O2 (322.1681)

Cannagunin|cannagunine|ent-1-methyl-19-oxa-19a-homo-yohimb-16-en-18-one|ent-19-hydroxy-1-methyl-18,19-seco-yohimb-16c-en-18-oic acid lactone

C20H22N2O2 (322.1681)

12-methoxy-cura-2(16),19-dien-17-al|Vincanicin

C20H22N2O2 (322.1681)

10-methoxy-nor-C-fluorocurarine|10-Methoxynor-C-fluorocurarine

C20H22N2O2 (322.1681)

Vincanicine

C20H22N2O2 (322.1681)

Koumine N-oxide

15-ethenyl-13-methyl-13-oxido-19-oxa-3-aza-13-azoniahexacyclo[14.3.1.02,10.04,9.010,15.012,17]icosa-2,4,6,8-tetraene

C20H22N2O2 (322.1681)

C20H22N2O2_2H-2,7a-Methanoindolo[2,3-a]quinolizine-13-carboxylic acid, 3-ethylidene-1,3,4,6,7,12b-hexahydro-, methyl ester, (3Z)

NCGC00385920-01_C20H22N2O2_2H-2,7a-Methanoindolo[2,3-a]quinolizine-13-carboxylic acid, 3-ethylidene-1,3,4,6,7,12b-hexahydro-, methyl ester, (3Z)-

C20H22N2O2 (322.1681)

Haplamidine

N-[4-[[(E)-3-phenylprop-2-enoyl]amino]butyl]benzamide

C20H22N2O2 (322.1681)

Origin: Plant; SubCategory_DNP: Putrescine alkaloids, Bisamide alkaloids

Solvent Blue 36

1,4-Bis(N-isopropylamino)anthraquinone

C20H22N2O2 (322.1681)

CONFIDENCE standard compound; INTERNAL_ID 529; DATASET 20200303_ENTACT_RP_MIX506; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 10471; ORIGINAL_PRECURSOR_SCAN_NO 10467 CONFIDENCE standard compound; INTERNAL_ID 529; DATASET 20200303_ENTACT_RP_MIX506; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 10492; ORIGINAL_PRECURSOR_SCAN_NO 10487 CONFIDENCE standard compound; INTERNAL_ID 529; DATASET 20200303_ENTACT_RP_MIX506; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 10546; ORIGINAL_PRECURSOR_SCAN_NO 10542

(S)-2-N-FMOC-AMINOMETHYL PYRROLIDINE

C20H22N2O2 (322.1681)

(S)-1-Fmoc-2-methyl-piperazine

C20H22N2O2 (322.1681)

CIS/TRANS-DISALYCYLIDENE-1,2-CYCLOHEXYLIDENEDIAMINE

C20H22N2O2 (322.1681)

(R)-(9H-fluoren-9-yl)Methyl 2-Methylpiperazine-1-carboxylate

C20H22N2O2 (322.1681)

1 4-DIBUTOXY-2 3-NAPHTHALENEDI-

C20H22N2O2 (322.1681)

Benzyl spiro[indoline-3,4-piperidine]-1-carboxylate

C20H22N2O2 (322.1681)

1-BENZYL-3H-SPIRO[BENZO[B][1,4]OXAZEPINE-2,4-PIPERIDIN]-4(5H)-ONE

C20H22N2O2 (322.1681)

(9H-Fluoren-9-yl)Methyl (pyrrolidin-2-ylmethyl)carbamate

C20H22N2O2 (322.1681)

tetrakis(ethylmethylamino)zirconium

C12H32N4Zr (322.1674)

6-Benzyl-2-(2-phenoxyethyl)-2,6-diazaspiro[3.3]heptan-1-one

C20H22N2O2 (322.1681)

N-[(2-Cyano-(1,1-biphenyl)-4-yl)methyl)]valine methyl ester

C20H22N2O2 (322.1681)

(3alpha,16alpha)-Eburnamenine-14-carboxylic acid

C20H22N2O2 (322.1681)

6-HYDROXY-1-ISOPROPYL-4-(4-ISOPROPYLPHENYL)QUINAZOLIN-2(1H)-ONE

C20H22N2O2 (322.1681)

Transfer ribonucleic acids

C20H22N2O2 (322.1681)

2H-2,7a-Methanoindolo[2,3-a]quinolizine-13-carboxylic acid, 3-ethylidene-1,3,4,6,7,12b-hexahydro-, methyl ester, (2R,3E,5S,7aR,12bS,13R)-

C20H22N2O2 (322.1681)

5-Ethylidene-17-methoxy-11-oxa-7,20-diazahexacyclo[11.7.0.02,7.04,9.08,12.014,19]icosa-1(13),14(19),15,17-tetraene

C20H22N2O2 (322.1681)

[(4R,5R)-5-ethenyl-1-azabicyclo[2.2.2]octan-2-yl]-(6-methoxyquinolin-4-yl)methanone

C20H22N2O2 (322.1681)

(2S,3S,5S,6R,11S)-2-ethenyl-4-methylspiro[1H-indole-3,7-9-oxa-4-azatetracyclo[6.3.1.02,6.05,11]dodecane]-2-one

C20H22N2O2 (322.1681)

(2S,3R,5S,6R,8S,11R)-2-Ethenyl-4-methylspiro[1H-indole-3,7-9-oxa-4-azatetracyclo[6.3.1.02,6.05,11]dodecane]-2-one

C20H22N2O2 (322.1681)

6-Methoxycinchonan-9-one

C20H22N2O2 (322.1681)

(E)-N-(4-Morpholin-4-ylmethyl-phenyl)-3-phenyl-acrylamide

C20H22N2O2 (322.1681)

[(5R)-5-ethenyl-1-azabicyclo[2.2.2]octan-2-yl]-(6-methoxyquinolin-4-yl)methanone

C20H22N2O2 (322.1681)

3,7,7-Trimethyl-4-(4-methylphenyl)-4,4a,6,8-tetrahydro-[1,2]oxazolo[5,4-b]quinolin-5-one

C20H22N2O2 (322.1681)

(5E)-5-ethylidene-17-methoxy-11-oxa-7,20-diazahexacyclo[11.7.0.02,7.04,9.08,12.014,19]icosa-1(13),14(19),15,17-tetraene

C20H22N2O2 (322.1681)

(2S,5E,8R,9R,12R)-5-ethylidene-17-methoxy-11-oxa-7,20-diazahexacyclo[11.7.0.02,7.04,9.08,12.014,19]icosa-1(13),14(19),15,17-tetraene

C20H22N2O2 (322.1681)

(19E)-2,16,19-20-Tetradehydrocuran-17-oic acid methyl ester

C20H22N2O2 (322.1681)

LSM-1353

C20H22N2O2 (322.1681)

UCSF924

C20H22N2O2 (322.1681)

UCSF924 is a potent and specific dopamine D4 receptor (DRD4) partial agonist with a EC50 of 4.2 nM. UCSF924 has a high-affinity with a Ki value of 3 nM for DRD4 and shows no measurable affinity for D2, D3 or the F261V/L328F D4 mutant. UCSF924 is a 7.4-fold bias toward arrestin over Gαi/o signaling, referenced to quinpirole[1].

methyl (1s,10r,12s,13z,18r)-13-ethylidene-8,15-diazapentacyclo[10.5.1.0¹,⁹.0²,⁷.0¹⁰,¹⁵]octadeca-2,4,6,8-tetraene-18-carboxylate

C20H22N2O2 (322.1681)

(10r,14s,16r,17s)-15-ethenyl-13-methyl-19-oxa-3,13-diazahexacyclo[14.3.1.0²,¹⁰.0⁴,⁹.0¹⁰,¹⁵.0¹²,¹⁷]icosa-2,4,6,8-tetraen-14-ol

C20H22N2O2 (322.1681)

(1s,8r,16s,17s)-12-methoxy-5,15-diazahexacyclo[13.4.2.0¹,¹⁶.0⁵,¹⁶.0⁸,¹⁷.0⁹,¹⁴]henicosa-2,9,11,13-tetraen-21-one

C20H22N2O2 (322.1681)

(1r,15s,21s)-3-methyl-17-oxa-3,13-diazapentacyclo[11.9.0.0²,¹⁰.0⁴,⁹.0¹⁵,²¹]docosa-2(10),4,6,8,19-pentaen-18-one

C20H22N2O2 (322.1681)

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

C20H22N2O2 (322.1681)

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

C20H22N2O2 (322.1681)

(1s,12s,13r,17e,18r)-17-ethylidene-3-methyl-15-oxa-3,20-diazapentacyclo[10.7.1.0²,¹⁰.0⁴,⁹.0¹³,¹⁸]icosa-2(10),4,6,8-tetraen-16-one

C20H22N2O2 (322.1681)

n-[2-(2,2-dimethylchromen-6-yl)ethyl]-n-methylpyridine-3-carboxamide

C20H22N2O2 (322.1681)

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

C20H22N2O2 (322.1681)

1-[(1s,12s,13r,18r)-20-methyl-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

C20H22N2O2 (322.1681)

methyl (13z,14s,16s,18s)-13-ethylidene-1,11-diazapentacyclo[12.3.1.0²,⁷.0⁸,¹⁷.0¹¹,¹⁶]octadeca-2,4,6,8(17)-tetraene-18-carboxylate

C20H22N2O2 (322.1681)

n-(4-{[hydroxy(phenyl)methylidene]amino}butyl)-3-phenylprop-2-enimidic acid

C20H22N2O2 (322.1681)

12-methoxyvellosimine

C20H22N2O2 (322.1681)

{"Ingredient_id": "HBIN000901","Ingredient_name": "12-methoxyvellosimine","Alias": "NA","Ingredient_formula": "C20H22N2O2","Ingredient_Smile": "CC=C1CN2C3CC1C(C2CC4=C3NC5=C4C=CC=C5OC)C=O","Ingredient_weight": "322.4 g/mol","OB_score": "NA","CAS_id": "NA","SymMap_id": "NA","TCMID_id": "14095","TCMSP_id": "NA","TCM_ID_id": "NA","PubChem_id": "101190312","DrugBank_id": "NA"}

alstolactone

C20H22N2O2 (322.1681)

{"Ingredient_id": "HBIN015764","Ingredient_name": "alstolactone","Alias": "NA","Ingredient_formula": "C20H22N2O2","Ingredient_Smile": "CC=C1C2CC3C4=C(CC(C2COC1=O)N3)C5=CC=CC=C5N4C","Ingredient_weight": "322.4 g/mol","OB_score": "NA","CAS_id": "NA","SymMap_id": "NA","TCMID_id": "995","TCMSP_id": "NA","TCM_ID_id": "NA","PubChem_id": "101727475","DrugBank_id": "NA"}