Exact Mass: 322.1632

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

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

Gardneral

16beta-Chlorotestosterone

16beta-Chloro-17beta-hydroxyandrost-4-en-3-one; 16beta-Chlorotestosterone

NCIOpen2_008973

19-Chloro-17beta-hydroxyandrost-4-en-3-one

Quinidinone

6-Methoxycinchonan-9-one

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*)]-

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.

Butyl (S)-3-hydroxybutyrate glucoside

Butyl 3-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}butanoic acid

Butyl (S)-3-hydroxybutyrate glucoside is found in fruits. Butyl (S)-3-hydroxybutyrate glucoside is a constituent of the fruit of mountain papaya Carica pubescens

10-(Phosphonooxy)decyl methacrylate

({10-[(2-methylprop-2-enoyl)oxy]decyl}oxy)phosphonic acid

C14H27O6P (322.1545)

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

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

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

Pericyclivine

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

12-Methoxy-vellosimine

Pleiocarpamine

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

Isoderricin A

7-Methoxy-8-prenylflavanone

MCULE-3875253942

(+)-Schizogaline

Norpurpeline

N-Demethylpurpeline

Alstolactone

Monamidocin

(S)-N-[5-[(Aminoiminomethyl)amino]-2-hydroxy-1-oxopentyl]-L-phenylalanine

Tiruchanduramine

C17H18N6O (322.1542)

N(4)-Demethylalstonerinal

1,4-Naphthalenedione, 6-[2-(2,2-dimethyl-6-methylene-3-oxocyclohexyl)ethyl]-

Endolobine

(-)-Isoschizogaline

Ochrosamine A

Panarine

Derricin

(E) -1- [ 2-Hydroxy-4-methoxy-3- (3-methyl-2-butenyl) phenyl ] -3-phenyl-2-propen-1-one

Gardnutine

Annotation level-1

Strychnopivotine

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

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.

Rengyoside A

1,5-DI-O-ACETYL-2,3,4,6-TETRA-O-METHYLHEXITOL (1-D)

4-[2-(4-hydroxyphenyl)ethyl]-6-[(3-methyl-2-butenyl)oxy]benzofuran|xinjiastilbene B

5-formylrhazinilam|rhazinal

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

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

4,10-Dimethyl-14,15-dihydro-7H-cyclohepta[1,2-a:5,4-a]dinaphthalene

C25H22 (322.1721)

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

Asnipyrone A

A member of the class of 2-pyranones that is 2H-pyran-2-one substituted by a methoxy group at position 4,a methyl group at position 3 and a 3,5-dimethyl-6-phenylhexa-1,3,5-trien-1-yl group at position 6 (the 1E,3E,5E stereoisomer). It has been isolated from an endophytic fungus Aspergillus niger.

Marsectobiose

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

N(4)-Demethylalstonerine

(Z,Z)-1,15-Diisothiocyanato-1,14-pentadecadiene

C17H26N2S2 (322.1537)

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

Venalstonine

Pterosin B benzoate

(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

Angustimicine

(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

12-hydroxynorfluorocurarine

ent-sandwicensin

3-hydroxyoctanoic acid O-beta-D-glucopyranoside

Amerovolficine

(+/-)-Norpurpeline

3,5-dihydroxy-6-methyl-octanoic acid 5-O-alpha-L-arabinofuranoside

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

Licochalcone a

2,4-dimethoxy-2,2-dimethylchromene(5,6,3,4)-stilbene|Di-Me ehter-(E)-7-[2-(2,4-Dihydroxyphenyl)ethenyl]-2,2-dimethyl-2H-1-benzopyran

2,2,6-Trimethyl-4-(butanoyloxymethyl)-5-(2-chloroethyl)indan

Marsectobiose (O4--D-oleandrose)|Marsectobiose [O4-(beta-D-Theretopyranosyl)-D-oleandrose]

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

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

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

C14H26O8

2-hydroxy-3-c-prenyl-4-methoxychalcone

Di-Me ether-(E)-Alnusone

Vincanicine

Methyl di-alpha-L-rhamnoside

Atropine sulfate

C17H24NO5S0.5 (322.1654)

L-HYOSCYAMINE SULFATE

C17H24NO5S0.5 (322.1654)

L-Hyoscyamine sulfate (Daturine sulfate), a natural plant tropane alkaloid, is a potent and competitive muscarinic receptor (MR) antagonist. L-Hyoscyamine sulfate is a levo-isomer to Atropine (HY-B1205)[1][2]. L-Hyoscyamine sulfate (Daturine sulfate), a natural plant tropane alkaloid, is a potent and competitive muscarinic receptor (MR) antagonist. L-Hyoscyamine sulfate is a levo-isomer to Atropine (HY-B1205)[1][2].

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_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)-

Makaluvamine K

[C19H20N3O2]+ (322.1555)

8:1+2O fatty acyl hexoside

Annotation level-3

Haplamidine

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

Origin: Plant; SubCategory_DNP: Putrescine alkaloids, Bisamide alkaloids

Solvent Blue 36

1,4-Bis(N-isopropylamino)anthraquinone

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

h_46_Clostebol_m

4-Chlorotestosterone

4-chloro-17beta-hydroxyandrost-4-en-3-one

Butyl (S)-3-hydroxybutyrate glucoside

butyl 3-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}butanoate

4-hydroxy Nonenal Mercapturic Acid-d3

C14H22D3NO5S (322.1642)

PtdIns-(1-arachidonoyl-d8, 2-arachidonoyl)

C14H22D3NO5S (322.1642)

Butyl 3-O-beta-D-glucopyranosyl-butanoate

Clostebol

4-chloro-17beta-hydroxyandrost-4-en-3-one

C147908 - Hormone Therapy Agent > C548 - Therapeutic Hormone > C2360 - Anabolic Steroid D006730 - Hormones, Hormone Substitutes, and Hormone Antagonists > D006728 - Hormones

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

7-FLUORO-N-(4-(PYRROLIDIN-1-YLMETHYL)PYRIDIN-2-YL)ISOQUINOLIN-3-AMINE

C19H19FN4 (322.1594)

Nonanal,2-(2,4-dinitrophenyl)hydrazone

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

CIS/TRANS-DISALYCYLIDENE-1,2-CYCLOHEXYLIDENEDIAMINE

10-(Phosphonooxy)decyl methacrylate

C14H27O6P (322.1545)

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

tert-butyl 4-(3-amino-2-nitrophenyl)piperazine-1-carboxylate

1 4-DIBUTOXY-2 3-NAPHTHALENEDI-

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

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

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

(3-Nitro-3,4,5,6-tetrahydro-2H-[1,2]bipyridinyl-4-yl)-carbamic acid tert-butyl ester

1H-Pyrrolo[2,3-b]pyridine, 3-(chloromethyl)-1-[tris(1-methylethyl)silyl]-

C17H27ClN2Si (322.1632)

4-CHLORO-5-METHYL-1-(TRIISOPROPYLSILYL)-1H-PYRROLO[2,3-B]PYRIDINE

C17H27ClN2Si (322.1632)

1,2-BIS((2R,5R)-2,5-DIMETHYLPHOSPHOLANO&

C18H28OP2 (322.1615)

1-tert-Butyl 4-ethyl 4-(aminomethyl)piperidine-1,4-dicarboxylate

C14H27ClN2O4 (322.1659)

tetrakis(ethylmethylamino)zirconium

C12H32N4Zr (322.1674)

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

1-[4-(2-Phenylethyl)benzyl]naphthalene

C25H22 (322.1721)

tert-butyl 4-(3-amino-4-nitrophenyl)piperazine-1-carboxylate

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

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

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

thonzylamine hydrochloride

C16H23ClN4O (322.156)

D018377 - Neurotransmitter Agents > D018494 - Histamine Agents > D006633 - Histamine Antagonists C308 - Immunotherapeutic Agent > C29578 - Histamine-1 Receptor Antagonist

Transfer ribonucleic acids

Methyl 4,5-dimethoxy-2-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)benzoate

C16H23BO6 (322.1588)

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)-

19-Chloro-17beta-hydroxyandrost-4-en-3-one

16beta-Chloro-17beta-hydroxyandrost-4-en-3-one

Silane, 9,10-anthracenediylbis[trimethyl-

C20H26Si2 (322.1573)

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

D-Galactitol, 1,3,4,5-tetra-O-methyl-, diacetate

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

(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

(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

1-Cyclohexyl-3-[1-(3,4-dimethoxyphenyl)ethyl]thiourea

C17H26N2O2S (322.1715)

6-Methoxycinchonan-9-one

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

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

N-(morpholin-4-ylcarbonothioyl)tricyclo[4.3.1.1~3,8~]undecane-3-carboxamide

C17H26N2O2S (322.1715)

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

C19H20N3O2+ (322.1555)

N-pyrazin-2-yl-2-({1-[2-(1H-pyrazol-1-yl)phenyl]ethyl}amino)acetamide

C17H18N6O (322.1542)

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

9-(2,4,7-Trimethylindan-1-ylidene)-9H-fluorene

C25H22 (322.1721)

(R)-imazamox-ammonium

(S)-imazamox-ammonium

(5-Acetyloxy-1-deuterio-2,3,4,6-tetramethoxyhexyl) acetate

4-chloro-17beta-hydroxyandrost-4-en-3-one

9-(Para-phenoxyphnyl)-2,4-nonadienoic acid

(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

(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

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

LSM-1353

UCSF924

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

(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

(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

(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

6-[2-(3,5-dimethoxyphenyl)ethenyl]-2,2-dimethylchromene

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

(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

(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

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

(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

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

6-{2-[(1s)-2,2-dimethyl-6-methylidene-3-oxocyclohexyl]ethyl}naphthalene-1,4-dione

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

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

12-methoxyvellosimine

{"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

{"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"}

benzoylpterosin b