Chemical Formula: C23H26N2O4
Chemical Formula C23H26N2O4
Found 41 metabolite its formula value is C23H26N2O4
Brucine
C23H26N2O4 (394.18924760000004)
D018373 - Peripheral Nervous System Agents > D018689 - Sensory System Agents D019995 - Laboratory Chemicals > D007202 - Indicators and Reagents D002491 - Central Nervous System Agents > D000700 - Analgesics D007155 - Immunologic Factors CONFIDENCE Reference Standard (Level 1); INTERNAL_ID 2329 relative retention time with respect to 9-anthracene Carboxylic Acid is 0.545 relative retention time with respect to 9-anthracene Carboxylic Acid is 0.540 ORIGINAL_ACQUISITION_NO 5860; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; CONFIDENCE standard compound; INTERNAL_ID 971; DATASET 20200303_ENTACT_RP_MIX502; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; ORIGINAL_PRECURSOR_SCAN_NO 5859 CONFIDENCE standard compound; INTERNAL_ID 971; DATASET 20200303_ENTACT_RP_MIX502; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 5850; ORIGINAL_PRECURSOR_SCAN_NO 5847 CONFIDENCE standard compound; INTERNAL_ID 971; DATASET 20200303_ENTACT_RP_MIX502; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 5870; ORIGINAL_PRECURSOR_SCAN_NO 5868 CONFIDENCE standard compound; INTERNAL_ID 971; DATASET 20200303_ENTACT_RP_MIX502; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 5860; ORIGINAL_PRECURSOR_SCAN_NO 5859 CONFIDENCE standard compound; INTERNAL_ID 971; DATASET 20200303_ENTACT_RP_MIX502; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 5841; ORIGINAL_PRECURSOR_SCAN_NO 5839 CONFIDENCE standard compound; INTERNAL_ID 971; DATASET 20200303_ENTACT_RP_MIX502; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 5876; ORIGINAL_PRECURSOR_SCAN_NO 5873 CONFIDENCE standard compound; INTERNAL_ID 971; DATASET 20200303_ENTACT_RP_MIX502; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 5855; ORIGINAL_PRECURSOR_SCAN_NO 5853 [Raw Data] CBA35_Brucine_pos_40eV_1-3_01_1629.txt [Raw Data] CBA35_Brucine_pos_10eV_1-3_01_1618.txt [Raw Data] CBA35_Brucine_pos_30eV_1-3_01_1628.txt [Raw Data] CBA35_Brucine_pos_20eV_1-3_01_1627.txt [Raw Data] CBA35_Brucine_pos_50eV_1-3_01_1630.txt
Brucine
C23H26N2O4 (394.18924760000004)
Akuammiline
C23H26N2O4 (394.18924760000004)
Akuammiline is a monoterpenoid indole alkaloid.
Brucin
C23H26N2O4 (394.18924760000004)
D018373 - Peripheral Nervous System Agents > D018689 - Sensory System Agents D019995 - Laboratory Chemicals > D007202 - Indicators and Reagents D002491 - Central Nervous System Agents > D000700 - Analgesics D007155 - Immunologic Factors
isobrucine
C23H26N2O4 (394.18924760000004)
A monoterpenoid indole alkaloid with formula C23H26N2O4, originally isolated from the seeds of Strychnos nux-vomica.
(16S)-17-Acetoxy-sarpagan-16-carbonsaeure-methylester|(16S)-17-acetoxy-sarpagane-16-carboxylic acid methyl ester|Acetylakuammidin|Monoacetylrhazin|O-Acetyl-rhazin|Polyneuridinacetat
C23H26N2O4 (394.18924760000004)
11-Methoxyicajine|3-methoxy-19-methyl-16,19-seco-strychnidine-10,16-dione|3-Methoxy-icajin|3-methoxy-icajine|3-methoxyicajine|N-methyl-sec-pseudo-alpha-colubrine
C23H26N2O4 (394.18924760000004)
N, N-p-Cinnamoyl, caffeoylcadaverine
C23H26N2O4 (394.18924760000004)
Brucine - CASMI2016 Category 1 - Challenge 9
C23H26N2O4 (394.18924760000004)
C23H26N2O4_2,3-Dimethoxystrychnidin-10-one
C23H26N2O4 (394.18924760000004)
(4aR,5aS,8aR,15bR)-10,11-dimethoxy-4a,5,5a,7,8,13a,15,15a,15b,16-decahydro-2H-4,6-methanoindolo[3,2,1-ij]oxepino[2,3,4-de]pyrrolo[2,3-h]quinoline-14-one
C23H26N2O4 (394.18924760000004)
2-[Oxo-[2-[oxo-(2-phenylethylamino)methyl]anilino]methyl]-1-cyclohexanecarboxylic acid
C23H26N2O4 (394.18924760000004)
2-[[1-[[3-(2-Hydroxyethoxy)phenyl]methyl]-4-piperidinyl]methyl]isoindole-1,3-dione
C23H26N2O4 (394.18924760000004)
methyl (13z)-18-[(acetyloxy)methyl]-13-ethylidene-8,15-diazapentacyclo[10.5.1.0¹,⁹.0²,⁷.0¹⁰,¹⁵]octadeca-2,4,6,8-tetraene-18-carboxylate
C23H26N2O4 (394.18924760000004)
(1r,13s,14z,19s,21s)-14-(2-hydroxyethylidene)-4,5-dimethoxy-8,16-diazahexacyclo[11.5.2.1¹,⁸.0²,⁷.0¹⁶,¹⁹.0¹²,²¹]henicosa-2(7),3,5,11-tetraen-9-one
C23H26N2O4 (394.18924760000004)
methyl (1s,10s,12s,13e,18r)-18-[(acetyloxy)methyl]-13-ethylidene-8,15-diazapentacyclo[10.5.1.0¹,⁹.0²,⁷.0¹⁰,¹⁵]octadeca-2,4,6,8-tetraene-18-carboxylate
C23H26N2O4 (394.18924760000004)
3-methoxyicajine
C23H26N2O4 (394.18924760000004)
{"Ingredient_id": "HBIN008834","Ingredient_name": "3-methoxyicajine","Alias": "NA","Ingredient_formula": "C23H26N2O4","Ingredient_Smile": "CN1CCC23C4C5C(CC2=O)C(=C(COC5CC(=O)N4C6=CC=CC=C36)OC)C1","Ingredient_weight": "394.5 g/mol","OB_score": "NA","CAS_id": "NA","SymMap_id": "SMIT16510","TCMID_id": "13965","TCMSP_id": "NA","TCM_ID_id": "NA","PubChem_id": "71453399","DrugBank_id": "NA"}
methyl (1s,14s,15z)-13-[(acetyloxy)methyl]-15-ethylidene-3,17-diazapentacyclo[12.3.1.0²,¹⁰.0⁴,⁹.0¹²,¹⁷]octadeca-2(10),4,6,8-tetraene-13-carboxylate
C23H26N2O4 (394.18924760000004)
2-{16-methyl-15-oxa-1,11-diazahexacyclo[15.3.1.0⁴,¹².0⁴,²⁰.0⁵,¹⁰.0¹³,¹⁸]henicosa-5,7,9,13-tetraen-11-yl}-2-oxoethyl acetate
C23H26N2O4 (394.18924760000004)
(12s,13r,14s,19r,21s)-11-acetyl-15-oxa-1,11-diazahexacyclo[16.3.1.0⁴,¹².0⁴,²¹.0⁵,¹⁰.0¹³,¹⁹]docosa-5,7,9,17-tetraen-14-yl acetate
C23H26N2O4 (394.18924760000004)
methyl 18-(acetyloxy)-3,13-diazapentacyclo[11.8.0.0²,¹⁰.0⁴,⁹.0¹⁵,²⁰]henicosa-2(10),4,6,8,15-pentaene-19-carboxylate
C23H26N2O4 (394.18924760000004)
2-[(4r,12r,16r,17s,18s,20s)-16-methyl-15-oxa-1,11-diazahexacyclo[15.3.1.0⁴,¹².0⁴,²⁰.0⁵,¹⁰.0¹³,¹⁸]henicosa-5,7,9,13-tetraen-11-yl]-2-oxoethyl acetate
C23H26N2O4 (394.18924760000004)
methyl (1s,10s,12s,13e,18s)-18-[(acetyloxy)methyl]-13-ethylidene-8,15-diazapentacyclo[10.5.1.0¹,⁹.0²,⁷.0¹⁰,¹⁵]octadeca-2,4,6,8-tetraene-18-carboxylate
C23H26N2O4 (394.18924760000004)
methyl (13e)-18-[(acetyloxy)methyl]-13-ethylidene-8,15-diazapentacyclo[10.5.1.0¹,⁹.0²,⁷.0¹⁰,¹⁵]octadeca-2,4,6,8-tetraene-18-carboxylate
C23H26N2O4 (394.18924760000004)
16-methoxy-4-methyl-9-oxa-4,13-diazahexacyclo[9.8.3.2¹⁰,¹³.0¹,¹².0⁶,²².0¹⁴,¹⁹]tetracosa-6,14,16,18-tetraene-20,23-dione
C23H26N2O4 (394.18924760000004)
2,18-dimethyl (1s,9r,16r,21s)-2,12-diazahexacyclo[14.2.2.1⁹,¹².0¹,⁹.0³,⁸.0¹⁶,²¹]henicosa-3,5,7,17-tetraene-2,18-dicarboxylate
C23H26N2O4 (394.18924760000004)
(1r,13s,14e,19s,21s)-14-(2-hydroxyethylidene)-4,5-dimethoxy-8,16-diazahexacyclo[11.5.2.1¹,⁸.0²,⁷.0¹⁶,¹⁹.0¹²,²¹]henicosa-2(7),3,5,11-tetraen-9-one
C23H26N2O4 (394.18924760000004)
methyl (1s,18s,19r,20r)-18-(acetyloxy)-3,13-diazapentacyclo[11.8.0.0²,¹⁰.0⁴,⁹.0¹⁵,²⁰]henicosa-2(10),4,6,8,15-pentaene-19-carboxylate
C23H26N2O4 (394.18924760000004)
(1r,11s,18s,20r,21s,22s)-4,5-dimethoxy-12-oxa-8,17-diazaheptacyclo[15.5.2.0¹,¹⁸.0²,⁷.0⁸,²².0¹¹,²¹.0¹⁵,²⁰]tetracosa-2(7),3,5,14-tetraen-9-one
C23H26N2O4 (394.18924760000004)
methyl (1s,10s,12r,18r)-18-[(acetyloxy)methyl]-13-ethylidene-8,15-diazapentacyclo[10.5.1.0¹,⁹.0²,⁷.0¹⁰,¹⁵]octadeca-2,4,6,8-tetraene-18-carboxylate
C23H26N2O4 (394.18924760000004)
(1s,10s,11r,12s,22r)-16-methoxy-4-methyl-9-oxa-4,13-diazahexacyclo[9.8.3.2¹⁰,¹³.0¹,¹².0⁶,²².0¹⁴,¹⁹]tetracosa-6,14,16,18-tetraene-20,23-dione
C23H26N2O4 (394.18924760000004)