Exact Mass: 633.2913977999999

Exact Mass Matches: 633.2913977999999

Found 41 metabolites which its exact mass value is equals to given mass value 633.2913977999999, within given mass tolerance error 0.01 dalton. Try search metabolite list with more accurate mass tolerance error 0.001 dalton.

penitrem A

NCGC00163403-03_C37H44ClNO6_(2R,3S,3aR,4aS,4bS,6aR,7S,7dR,8S,9aR,14bS,14cR,16aS)-12-Chloro-2-isopropenyl-14b,14c,17,17-tetramethyl-10-methylene-3,3a,6,6a,7,8,9,9a,10,11,14,14b,14c,15,16,16a-hexadecahydro-2H,4bH-7,8-(epoxymethano)cyclobuta[5,6]benzo[1,2-e]oxireno[4,4a]chromeno[5,6:6,7]indeno[1,2-b]indole-3,4b,7d(5H)-triol

C37H44ClNO6 (633.2856993999999)


D009676 - Noxae > D011042 - Poisons > D009183 - Mycotoxins CONFIDENCE Reference Standard (Level 1) Penitrem A is an indole diterpene neurotoxic alkaloid produced by Penicillium, acts as a selective BK channel antagonist with antiproliferative and anti-invasive activities against multiple malignancies. Penitrem A increases the spontaneous release of endogenous glutamate, gamma-aminobutyric acid (GABA) and aspartate from cerebrocortical synaptosomes, and induces tremorgenic syndromes in animals[1][2].

   

Pennigritrem

(1S,2R,5S,6S,8R,9S,12S,14S,17R,18S,27R,29S,30R)-23-chloro-11,11,17,18,35,35-hexamethyl-26-methylidene-7,10,13,34-tetraoxa-20-azaundecacyclo[27.4.2.02,18.05,17.06,8.06,14.09,12.019,33.021,32.024,31.027,30]pentatriaconta-19(33),21,23,31-tetraene-5,30-diol

C37H44ClNO6 (633.2856993999999)


   

penitrem A

21-chloro-15,16,33,33-tetramethyl-24-methylidene-10-(prop-1-en-2-yl)-7,11,32-trioxa-18-azadecacyclo[25.4.2.0²,¹⁶.0⁵,¹⁵.0⁶,⁸.0⁶,¹².0¹⁷,³¹.0¹⁹,³⁰.0²²,²⁹.0²⁵,²⁸]tritriaconta-17(31),19,21,29-tetraene-5,9,28-triol

C37H44ClNO6 (633.2856993999999)


D009676 - Noxae > D011042 - Poisons > D009183 - Mycotoxins Penitrem A is an indole diterpene neurotoxic alkaloid produced by Penicillium, acts as a selective BK channel antagonist with antiproliferative and anti-invasive activities against multiple malignancies. Penitrem A increases the spontaneous release of endogenous glutamate, gamma-aminobutyric acid (GABA) and aspartate from cerebrocortical synaptosomes, and induces tremorgenic syndromes in animals[1][2].

   

Golvatinib

N1-{2-fluoro-4-[(2-{[4-(4-methylpiperazin-1-yl)piperidine-1-carbonyl]amino}pyridin-4-yl)oxy]phenyl}-N1-(4-fluorophenyl)cyclopropane-1,1-dicarboxamide

C33H37F2N7O4 (633.2874946)


C274 - Antineoplastic Agent > C2189 - Signal Transduction Inhibitor > C129824 - Antineoplastic Protein Inhibitor C471 - Enzyme Inhibitor > C129825 - Antineoplastic Enzyme Inhibitor C471 - Enzyme Inhibitor > C1404 - Protein Kinase Inhibitor

   

Thomitrem A

Thomitrem A

C37H44ClNO6 (633.2856993999999)


   

Cardiopidine

Cardiopidine

C36H43NO9 (633.2937668000001)


   

Cardiopine

Cardiopine

C36H43NO9 (633.2937668000001)


   

C37H44ClNO6_(2aS,2bR,3aS,3bS,6S,6dR,7S,8aR,13bS,13cR,15aS,16aS)-11-Chloro-1,1,13b,13c,17,17-hexamethyl-9-methylene-1,2a,2b,5,5a,6,7,8,8a,9,10,13,13b,13c,14,15,15a,16a-octadecahydro-3bH-6,7-(epoxymethano)cyclobuta[5,6]benzo[1,2-e]oxeto[3,2:2,3]oxireno[4,4a]chromeno[5,6:6,7]indeno[1,2-b]indole-3b,6d(4H)-diol

NCGC00380694-01_C37H44ClNO6_(2aS,2bR,3aS,3bS,6S,6dR,7S,8aR,13bS,13cR,15aS,16aS)-11-Chloro-1,1,13b,13c,17,17-hexamethyl-9-methylene-1,2a,2b,5,5a,6,7,8,8a,9,10,13,13b,13c,14,15,15a,16a-octadecahydro-3bH-6,7-(epoxymethano)cyclobuta[5,6]benzo[1,2-e]oxeto[3,2:2,3]oxireno[4,4a]chromeno[5,6:6,7]indeno[1,2-b]indole-3b,6d(4H)-diol

C37H44ClNO6 (633.2856993999999)


   

Asp Lys Trp Trp

(3S)-3-amino-3-{[(1S)-5-amino-1-{[(1S)-1-{[(1S)-1-carboxy-2-(1H-indol-3-yl)ethyl]carbamoyl}-2-(1H-indol-3-yl)ethyl]carbamoyl}pentyl]carbamoyl}propanoic acid

C32H39N7O7 (633.2910824)


   

Asp Trp Lys Trp

(3S)-3-amino-3-{[(1S)-1-{[(1S)-5-amino-1-{[(1S)-1-carboxy-2-(1H-indol-3-yl)ethyl]carbamoyl}pentyl]carbamoyl}-2-(1H-indol-3-yl)ethyl]carbamoyl}propanoic acid

C32H39N7O7 (633.2910824)


   

Asp Trp Trp Lys

(2S)-6-amino-2-[(2S)-2-[(2S)-2-[(2S)-2-amino-3-carboxypropanamido]-3-(1H-indol-3-yl)propanamido]-3-(1H-indol-3-yl)propanamido]hexanoic acid

C32H39N7O7 (633.2910824)


   

Lys Asp Trp Trp

(3S)-3-{[(1S)-1-{[(1S)-1-carboxy-2-(1H-indol-3-yl)ethyl]carbamoyl}-2-(1H-indol-3-yl)ethyl]carbamoyl}-3-[(2S)-2,6-diaminohexanamido]propanoic acid

C32H39N7O7 (633.2910824)


   

Lys Trp Asp Trp

(3S)-3-{[(1S)-1-carboxy-2-(1H-indol-3-yl)ethyl]carbamoyl}-3-[(2S)-2-[(2S)-2,6-diaminohexanamido]-3-(1H-indol-3-yl)propanamido]propanoic acid

C32H39N7O7 (633.2910824)


   

Lys Trp Trp Asp

(2S)-2-[(2S)-2-[(2S)-2-[(2S)-2,6-diaminohexanamido]-3-(1H-indol-3-yl)propanamido]-3-(1H-indol-3-yl)propanamido]butanedioic acid

C32H39N7O7 (633.2910824)


   

Trp Asp Lys Trp

(3S)-3-{[(1S)-5-amino-1-{[(1S)-1-carboxy-2-(1H-indol-3-yl)ethyl]carbamoyl}pentyl]carbamoyl}-3-[(2S)-2-amino-3-(1H-indol-3-yl)propanamido]propanoic acid

C32H39N7O7 (633.2910824)


   

Trp Asp Trp Lys

(2S)-6-amino-2-[(2S)-2-[(2S)-2-[(2S)-2-amino-3-(1H-indol-3-yl)propanamido]-3-carboxypropanamido]-3-(1H-indol-3-yl)propanamido]hexanoic acid

C32H39N7O7 (633.2910824)


   

Trp Lys Asp Trp

(3S)-3-[(2S)-6-amino-2-[(2S)-2-amino-3-(1H-indol-3-yl)propanamido]hexanamido]-3-{[(1S)-1-carboxy-2-(1H-indol-3-yl)ethyl]carbamoyl}propanoic acid

C32H39N7O7 (633.2910824)


   

Trp Lys Trp Asp

(2S)-2-[(2S)-2-[(2S)-6-amino-2-[(2S)-2-amino-3-(1H-indol-3-yl)propanamido]hexanamido]-3-(1H-indol-3-yl)propanamido]butanedioic acid

C32H39N7O7 (633.2910824)


   

Trp Trp Asp Lys

(2S)-6-amino-2-[(2S)-2-[(2S)-2-[(2S)-2-amino-3-(1H-indol-3-yl)propanamido]-3-(1H-indol-3-yl)propanamido]-3-carboxypropanamido]hexanoic acid

C32H39N7O7 (633.2910824)


   

Trp Trp Lys Asp

(2S)-2-[(2S)-6-amino-2-[(2S)-2-[(2S)-2-amino-3-(1H-indol-3-yl)propanamido]-3-(1H-indol-3-yl)propanamido]hexanamido]butanedioic acid

C32H39N7O7 (633.2910824)


   

Golvatinib

Golvatinib (E7050)

C33H37F2N7O4 (633.2874946)


C274 - Antineoplastic Agent > C2189 - Signal Transduction Inhibitor > C129824 - Antineoplastic Protein Inhibitor C471 - Enzyme Inhibitor > C129825 - Antineoplastic Enzyme Inhibitor C471 - Enzyme Inhibitor > C1404 - Protein Kinase Inhibitor

   

(1S,2R,5S,6S,8R,9S,12S,14S,17R,18S,27R,29S,30R)-23-chloro-11,11,17,18,35,35-hexamethyl-26-methylidene-7,10,13,34-tetraoxa-20-azaundecacyclo[27.4.2.02,18.05,17.06,8.06,14.09,12.019,33.021,32.024,31.027,30]pentatriaconta-19(33),21,23,31-tetraene-5,30-diol

(1S,2R,5S,6S,8R,9S,12S,14S,17R,18S,27R,29S,30R)-23-chloro-11,11,17,18,35,35-hexamethyl-26-methylidene-7,10,13,34-tetraoxa-20-azaundecacyclo[27.4.2.02,18.05,17.06,8.06,14.09,12.019,33.021,32.024,31.027,30]pentatriaconta-19(33),21,23,31-tetraene-5,30-diol

C37H44ClNO6 (633.2856993999999)


   

PS O-23:5;O3

PS O-23:5;O3

C29H48NO12P (633.2913977999999)


   

PS P-16:1/7:3;O3

PS P-16:1/7:3;O3

C29H48NO12P (633.2913977999999)


   

PS 14:0/9:4;O2

PS 14:0/9:4;O2

C29H48NO12P (633.2913977999999)


   

PS 16:1/7:3;O2

PS 16:1/7:3;O2

C29H48NO12P (633.2913977999999)


   

PS 18:3/5:1;O2

PS 18:3/5:1;O2

C29H48NO12P (633.2913977999999)


   

PS 23:4;O2

PS 23:4;O2

C29H48NO12P (633.2913977999999)


   

(1s,2s,3s,4s,5s,8s,9r,10r,11s,14s,16r,17s,18s,19s)-2,19-bis(acetyloxy)-3-hydroxy-5-methyl-4-{[(2s)-2-methylbutanoyl]oxy}-12-methylidene-7-azaheptacyclo[9.6.2.0¹,⁸.0⁵,¹⁷.0⁷,¹⁶.0⁹,¹⁴.0¹⁴,¹⁸]nonadecan-10-yl benzoate

(1s,2s,3s,4s,5s,8s,9r,10r,11s,14s,16r,17s,18s,19s)-2,19-bis(acetyloxy)-3-hydroxy-5-methyl-4-{[(2s)-2-methylbutanoyl]oxy}-12-methylidene-7-azaheptacyclo[9.6.2.0¹,⁸.0⁵,¹⁷.0⁷,¹⁶.0⁹,¹⁴.0¹⁴,¹⁸]nonadecan-10-yl benzoate

C36H43NO9 (633.2937668000001)


   

(1r,2s,3s,4s,5s,8r,9s,11r,14r,16s,17r,18r,19s)-2,19-bis(acetyloxy)-3-hydroxy-5-methyl-4-[(2-methylbutanoyl)oxy]-12-methylidene-7-azaheptacyclo[9.6.2.0¹,⁸.0⁵,¹⁷.0⁷,¹⁶.0⁹,¹⁴.0¹⁴,¹⁸]nonadecan-10-yl benzoate

(1r,2s,3s,4s,5s,8r,9s,11r,14r,16s,17r,18r,19s)-2,19-bis(acetyloxy)-3-hydroxy-5-methyl-4-[(2-methylbutanoyl)oxy]-12-methylidene-7-azaheptacyclo[9.6.2.0¹,⁸.0⁵,¹⁷.0⁷,¹⁶.0⁹,¹⁴.0¹⁴,¹⁸]nonadecan-10-yl benzoate

C36H43NO9 (633.2937668000001)


   

(2s,3r,6s,8r,9s,10r,12r,13s,21s,22r,24r)-28-chloro-22-(2-hydroxypropan-2-yl)-2,3-dimethyl-25-methylidene-8-(prop-1-en-2-yl)-7,11-dioxa-31-azanonacyclo[16.13.0.0²,¹⁶.0³,¹³.0⁶,¹².0¹⁰,¹².0¹⁹,³⁰.0²⁰,²⁷.0²¹,²⁴]hentriaconta-1(18),16,19,27,29-pentaene-9,13,21-triol

(2s,3r,6s,8r,9s,10r,12r,13s,21s,22r,24r)-28-chloro-22-(2-hydroxypropan-2-yl)-2,3-dimethyl-25-methylidene-8-(prop-1-en-2-yl)-7,11-dioxa-31-azanonacyclo[16.13.0.0²,¹⁶.0³,¹³.0⁶,¹².0¹⁰,¹².0¹⁹,³⁰.0²⁰,²⁷.0²¹,²⁴]hentriaconta-1(18),16,19,27,29-pentaene-9,13,21-triol

C37H44ClNO6 (633.2856993999999)


   

(2s,3r,6s,8r,9s,10r,12s,13s,21r,22r,24r)-28-chloro-22-(2-hydroxypropan-2-yl)-2,3-dimethyl-25-methylidene-8-(prop-1-en-2-yl)-7,11-dioxa-31-azanonacyclo[16.13.0.0²,¹⁶.0³,¹³.0⁶,¹².0¹⁰,¹².0¹⁹,³⁰.0²⁰,²⁷.0²¹,²⁴]hentriaconta-1(18),16,19,27,29-pentaene-9,13,21-triol

(2s,3r,6s,8r,9s,10r,12s,13s,21r,22r,24r)-28-chloro-22-(2-hydroxypropan-2-yl)-2,3-dimethyl-25-methylidene-8-(prop-1-en-2-yl)-7,11-dioxa-31-azanonacyclo[16.13.0.0²,¹⁶.0³,¹³.0⁶,¹².0¹⁰,¹².0¹⁹,³⁰.0²⁰,²⁷.0²¹,²⁴]hentriaconta-1(18),16,19,27,29-pentaene-9,13,21-triol

C37H44ClNO6 (633.2856993999999)


   

(1s,2r,3s,4r,5s,8s,9r,10r,11s,14s,16r,17s,18s,19s)-2,19-bis(acetyloxy)-4-hydroxy-5-methyl-3-{[(2r)-2-methylbutanoyl]oxy}-12-methylidene-7-azaheptacyclo[9.6.2.0¹,⁸.0⁵,¹⁷.0⁷,¹⁶.0⁹,¹⁴.0¹⁴,¹⁸]nonadecan-10-yl benzoate

(1s,2r,3s,4r,5s,8s,9r,10r,11s,14s,16r,17s,18s,19s)-2,19-bis(acetyloxy)-4-hydroxy-5-methyl-3-{[(2r)-2-methylbutanoyl]oxy}-12-methylidene-7-azaheptacyclo[9.6.2.0¹,⁸.0⁵,¹⁷.0⁷,¹⁶.0⁹,¹⁴.0¹⁴,¹⁸]nonadecan-10-yl benzoate

C36H43NO9 (633.2937668000001)


   

(1s,2r,5s,6s,8r,9s,12s,14s,17r,18s,27r,29s,30r)-23-chloro-11,11,17,18,35,35-hexamethyl-26-methylidene-7,10,13,34-tetraoxa-20-azaundecacyclo[27.4.2.0²,¹⁸.0⁵,¹⁷.0⁶,⁸.0⁶,¹⁴.0⁹,¹².0¹⁹,³³.0²¹,³².0²⁴,³¹.0²⁷,³⁰]pentatriaconta-19(33),21,23,31-tetraene-5,30-diol

(1s,2r,5s,6s,8r,9s,12s,14s,17r,18s,27r,29s,30r)-23-chloro-11,11,17,18,35,35-hexamethyl-26-methylidene-7,10,13,34-tetraoxa-20-azaundecacyclo[27.4.2.0²,¹⁸.0⁵,¹⁷.0⁶,⁸.0⁶,¹⁴.0⁹,¹².0¹⁹,³³.0²¹,³².0²⁴,³¹.0²⁷,³⁰]pentatriaconta-19(33),21,23,31-tetraene-5,30-diol

C37H44ClNO6 (633.2856993999999)


   

(2s,3r,6s,8r,9s,10s,12r,13s,22r,24r)-28-chloro-22-(2-hydroxypropan-2-yl)-2,3-dimethyl-25-methylidene-8-(prop-1-en-2-yl)-7,11-dioxa-31-azanonacyclo[16.13.0.0²,¹⁶.0³,¹³.0⁶,¹².0¹⁰,¹².0¹⁹,³⁰.0²⁰,²⁷.0²¹,²⁴]hentriaconta-1(18),16,19,27,29-pentaene-9,13,21-triol

(2s,3r,6s,8r,9s,10s,12r,13s,22r,24r)-28-chloro-22-(2-hydroxypropan-2-yl)-2,3-dimethyl-25-methylidene-8-(prop-1-en-2-yl)-7,11-dioxa-31-azanonacyclo[16.13.0.0²,¹⁶.0³,¹³.0⁶,¹².0¹⁰,¹².0¹⁹,³⁰.0²⁰,²⁷.0²¹,²⁴]hentriaconta-1(18),16,19,27,29-pentaene-9,13,21-triol

C37H44ClNO6 (633.2856993999999)


   

(1r,2s,3s,4s,5s,8r,9s,11r,14r,16s,17r,18r,19s)-2,19-bis(acetyloxy)-4-hydroxy-5-methyl-3-[(2-methylbutanoyl)oxy]-12-methylidene-7-azaheptacyclo[9.6.2.0¹,⁸.0⁵,¹⁷.0⁷,¹⁶.0⁹,¹⁴.0¹⁴,¹⁸]nonadecan-10-yl benzoate

(1r,2s,3s,4s,5s,8r,9s,11r,14r,16s,17r,18r,19s)-2,19-bis(acetyloxy)-4-hydroxy-5-methyl-3-[(2-methylbutanoyl)oxy]-12-methylidene-7-azaheptacyclo[9.6.2.0¹,⁸.0⁵,¹⁷.0⁷,¹⁶.0⁹,¹⁴.0¹⁴,¹⁸]nonadecan-10-yl benzoate

C36H43NO9 (633.2937668000001)


   

28-chloro-22-(2-hydroxypropan-2-yl)-2,3-dimethyl-25-methylidene-8-(prop-1-en-2-yl)-7,11-dioxa-31-azanonacyclo[16.13.0.0²,¹⁶.0³,¹³.0⁶,¹².0¹⁰,¹².0¹⁹,³⁰.0²⁰,²⁷.0²¹,²⁴]hentriaconta-1(18),16,19,27,29-pentaene-9,13,21-triol

28-chloro-22-(2-hydroxypropan-2-yl)-2,3-dimethyl-25-methylidene-8-(prop-1-en-2-yl)-7,11-dioxa-31-azanonacyclo[16.13.0.0²,¹⁶.0³,¹³.0⁶,¹².0¹⁰,¹².0¹⁹,³⁰.0²⁰,²⁷.0²¹,²⁴]hentriaconta-1(18),16,19,27,29-pentaene-9,13,21-triol

C37H44ClNO6 (633.2856993999999)


   

(1s,2r,5s,6s,8r,9s,10r,12s,15r,16s,25r,27s,28r)-21-chloro-15,16,33,33-tetramethyl-24-methylidene-10-(prop-1-en-2-yl)-7,11,32-trioxa-18-azadecacyclo[25.4.2.0²,¹⁶.0⁵,¹⁵.0⁶,⁸.0⁶,¹².0¹⁷,³¹.0¹⁹,³⁰.0²²,²⁹.0²⁵,²⁸]tritriaconta-17(31),19,21,29-tetraene-5,9,28-triol

(1s,2r,5s,6s,8r,9s,10r,12s,15r,16s,25r,27s,28r)-21-chloro-15,16,33,33-tetramethyl-24-methylidene-10-(prop-1-en-2-yl)-7,11,32-trioxa-18-azadecacyclo[25.4.2.0²,¹⁶.0⁵,¹⁵.0⁶,⁸.0⁶,¹².0¹⁷,³¹.0¹⁹,³⁰.0²²,²⁹.0²⁵,²⁸]tritriaconta-17(31),19,21,29-tetraene-5,9,28-triol

C37H44ClNO6 (633.2856993999999)


   

(1r,2s,5r,6r,8s,9r,10s,12r,15s,16r,25s,27r,28s)-21-chloro-15,16,33,33-tetramethyl-24-methylidene-10-(prop-1-en-2-yl)-7,11,32-trioxa-18-azadecacyclo[25.4.2.0²,¹⁶.0⁵,¹⁵.0⁶,⁸.0⁶,¹².0¹⁷,³¹.0¹⁹,³⁰.0²²,²⁹.0²⁵,²⁸]tritriaconta-17(31),19,21,29-tetraene-5,9,28-triol

(1r,2s,5r,6r,8s,9r,10s,12r,15s,16r,25s,27r,28s)-21-chloro-15,16,33,33-tetramethyl-24-methylidene-10-(prop-1-en-2-yl)-7,11,32-trioxa-18-azadecacyclo[25.4.2.0²,¹⁶.0⁵,¹⁵.0⁶,⁸.0⁶,¹².0¹⁷,³¹.0¹⁹,³⁰.0²²,²⁹.0²⁵,²⁸]tritriaconta-17(31),19,21,29-tetraene-5,9,28-triol

C37H44ClNO6 (633.2856993999999)


   

(1r,2s,5r,6s,8r,9r,10s,12r,15s,16r,25s,27r,28s)-21-chloro-15,16,33,33-tetramethyl-24-methylidene-10-(prop-1-en-2-yl)-7,11,32-trioxa-18-azadecacyclo[25.4.2.0²,¹⁶.0⁵,¹⁵.0⁶,⁸.0⁶,¹².0¹⁷,³¹.0¹⁹,³⁰.0²²,²⁹.0²⁵,²⁸]tritriaconta-17(31),19,21,29-tetraene-5,9,28-triol

(1r,2s,5r,6s,8r,9r,10s,12r,15s,16r,25s,27r,28s)-21-chloro-15,16,33,33-tetramethyl-24-methylidene-10-(prop-1-en-2-yl)-7,11,32-trioxa-18-azadecacyclo[25.4.2.0²,¹⁶.0⁵,¹⁵.0⁶,⁸.0⁶,¹².0¹⁷,³¹.0¹⁹,³⁰.0²²,²⁹.0²⁵,²⁸]tritriaconta-17(31),19,21,29-tetraene-5,9,28-triol

C37H44ClNO6 (633.2856993999999)


   

(1s,2r,5s,6r,8s,9s,10r,12s,15r,16s,25r,27s,28r)-21-chloro-15,16,33,33-tetramethyl-24-methylidene-10-(prop-1-en-2-yl)-7,11,32-trioxa-18-azadecacyclo[25.4.2.0²,¹⁶.0⁵,¹⁵.0⁶,⁸.0⁶,¹².0¹⁷,³¹.0¹⁹,³⁰.0²²,²⁹.0²⁵,²⁸]tritriaconta-17(31),19,21,29-tetraene-5,9,28-triol

(1s,2r,5s,6r,8s,9s,10r,12s,15r,16s,25r,27s,28r)-21-chloro-15,16,33,33-tetramethyl-24-methylidene-10-(prop-1-en-2-yl)-7,11,32-trioxa-18-azadecacyclo[25.4.2.0²,¹⁶.0⁵,¹⁵.0⁶,⁸.0⁶,¹².0¹⁷,³¹.0¹⁹,³⁰.0²²,²⁹.0²⁵,²⁸]tritriaconta-17(31),19,21,29-tetraene-5,9,28-triol

C37H44ClNO6 (633.2856993999999)