Exact Mass: 702.2894
Exact Mass Matches: 702.2894
Found 36 metabolites which its exact mass value is equals to given mass value 702.2894,
within given mass tolerance error 0.001 dalton. Try search metabolite list with more accurate mass tolerance error
0.0002 dalton.
Taccalonolide
[(1S,2S,3R,5S,7S,9S,10R,11R,12S,13S,14R,15R,16S,17S,22S,23S,24R,25R)-10,14,25-triacetyloxy-3,22-dihydroxy-11,15,17,22,23-pentamethyl-4,21-dioxo-8,20-dioxaheptacyclo[13.10.0.02,12.05,11.07,9.016,24.019,23]pentacos-18-en-13-yl] acetate
Taccalonolide A is a withanolide. Taccalonolide A is a natural product found in Tacca plantaginea and Tacca chantrieri with data available. Taccalonolide A is a microtubule stabilizer, which is a steroid isolated from Tacca chantrieri, with cytotoxic and antimalarial activities[1][2]. Taccalonolide A causes G2-M accumulation, Bcl-2 phosphorylation and initiation of apoptosis[1]. Taccalonolide A is effective in vitro against cell lines that overexpress P-glycoprotein (Pgp) and multidrug resistance protein 7 (MRP7), with an IC50 of 622 nM for SK-OV-3 cells[3].
Hexapeptide analogue
3-({3-carboxy-1-hydroxy-2-[(1-hydroxyethylidene)amino]propylidene}amino)-3-({1-[(1-{2-[(1-carboxy-2-sulphanylethyl)-C-hydroxycarbonimidoyl]pyrrolidin-1-yl}-3-methyl-1-oxobutan-2-yl)-C-hydroxycarbonimidoyl]-2-methylbutyl}-C-hydroxycarbonimidoyl)propanoic acid
Taccalonolide C
Taccalonolide C
Taccalonolide C is a natural product found in Tacca plantaginea with data available.
4,19,21-tris(acetyloxy)-6-(furan-3-yl)-12,20-dihydroxy-5,11,15-trimethyl-3-oxo-9,17-dioxahexacyclo[13.3.3.0¹,¹⁴.0²,¹¹.0⁵,¹⁰.0⁸,¹⁰]henicosan-16-yl 2-methylpropanoate
4,19,21-tris(acetyloxy)-6-(furan-3-yl)-12,20-dihydroxy-5,11,15-trimethyl-3-oxo-9,17-dioxahexacyclo[13.3.3.0¹,¹⁴.0²,¹¹.0⁵,¹⁰.0⁸,¹⁰]henicosan-16-yl 2-methylpropanoate
4,14,15-tris(acetyloxy)-22-hydroxy-12,16,18,21,22-pentamethyl-5,20,23-trioxo-9,24-dioxaheptacyclo[15.7.1.0²,¹⁶.0³,¹³.0⁶,¹².0⁸,¹⁰.0²¹,²⁵]pentacosan-11-yl acetate
4,14,15-tris(acetyloxy)-22-hydroxy-12,16,18,21,22-pentamethyl-5,20,23-trioxo-9,24-dioxaheptacyclo[15.7.1.0²,¹⁶.0³,¹³.0⁶,¹².0⁸,¹⁰.0²¹,²⁵]pentacosan-11-yl acetate
1-acetyl-2-deacetyltrichilin h
NA
{"Ingredient_id": "HBIN002252","Ingredient_name": "1-acetyl-2-deacetyltrichilin h","Alias": "NA","Ingredient_formula": "C36H46O14","Ingredient_Smile": "NA","Ingredient_weight": "702.751","OB_score": "NA","CAS_id": "NA","SymMap_id": "NA","TCMID_id": "NA","TCMSP_id": "NA","TCM_ID_id": "9243","PubChem_id": "NA","DrugBank_id": "NA"}
1-acetyl-3-deacetyltrichilin h
NA
{"Ingredient_id": "HBIN002253","Ingredient_name": "1-acetyl-3-deacetyltrichilin h","Alias": "NA","Ingredient_formula": "C36H46O14","Ingredient_Smile": "NA","Ingredient_weight": "702.751","OB_score": "NA","CAS_id": "NA","SymMap_id": "NA","TCMID_id": "NA","TCMSP_id": "NA","TCM_ID_id": "9242","PubChem_id": "NA","DrugBank_id": "NA"}
(1s,2r,4r,5r,6s,8r,10s,11s,12r,14r,15s,19r,20r,21s)-4,20,21-tris(acetyloxy)-6-(furan-3-yl)-12,19-dihydroxy-5,11,15-trimethyl-3-oxo-9,17-dioxahexacyclo[13.3.3.0¹,¹⁴.0²,¹¹.0⁵,¹⁰.0⁸,¹⁰]henicosan-16-yl 2-methylpropanoate
(1s,2r,4r,5r,6s,8r,10s,11s,12r,14r,15s,19r,20r,21s)-4,20,21-tris(acetyloxy)-6-(furan-3-yl)-12,19-dihydroxy-5,11,15-trimethyl-3-oxo-9,17-dioxahexacyclo[13.3.3.0¹,¹⁴.0²,¹¹.0⁵,¹⁰.0⁸,¹⁰]henicosan-16-yl 2-methylpropanoate
4,13,14-tris(acetyloxy)-22,25-dihydroxy-11,15,17,22,23-pentamethyl-3,21-dioxo-8,20-dioxaheptacyclo[13.10.0.0²,¹².0⁵,¹¹.0⁷,⁹.0¹⁶,²⁴.0¹⁹,²³]pentacos-18-en-10-yl acetate
4,13,14-tris(acetyloxy)-22,25-dihydroxy-11,15,17,22,23-pentamethyl-3,21-dioxo-8,20-dioxaheptacyclo[13.10.0.0²,¹².0⁵,¹¹.0⁷,⁹.0¹⁶,²⁴.0¹⁹,²³]pentacos-18-en-10-yl acetate
(1s,2s,3r,5s,7s,9s,10r,11r,12s,13s,14r,15r,16s,17s,22s,23s,24r,25r)-3,13,14-tris(acetyloxy)-22,25-dihydroxy-11,15,17,22,23-pentamethyl-4,21-dioxo-8,20-dioxaheptacyclo[13.10.0.0²,¹².0⁵,¹¹.0⁷,⁹.0¹⁶,²⁴.0¹⁹,²³]pentacos-18-en-10-yl acetate
(1s,2s,3r,5s,7s,9s,10r,11r,12s,13s,14r,15r,16s,17s,22s,23s,24r,25r)-3,13,14-tris(acetyloxy)-22,25-dihydroxy-11,15,17,22,23-pentamethyl-4,21-dioxo-8,20-dioxaheptacyclo[13.10.0.0²,¹².0⁵,¹¹.0⁷,⁹.0¹⁶,²⁴.0¹⁹,²³]pentacos-18-en-10-yl acetate
3,13,14-tris(acetyloxy)-22,25-dihydroxy-11,15,17,22,23-pentamethyl-4,21-dioxo-8,20-dioxaheptacyclo[13.10.0.0²,¹².0⁵,¹¹.0⁷,⁹.0¹⁶,²⁴.0¹⁹,²³]pentacos-18-en-10-yl acetate
3,13,14-tris(acetyloxy)-22,25-dihydroxy-11,15,17,22,23-pentamethyl-4,21-dioxo-8,20-dioxaheptacyclo[13.10.0.0²,¹².0⁵,¹¹.0⁷,⁹.0¹⁶,²⁴.0¹⁹,²³]pentacos-18-en-10-yl acetate
4,20,21-tris(acetyloxy)-6-(furan-3-yl)-12,19-dihydroxy-5,11,15-trimethyl-3-oxo-9,17-dioxahexacyclo[13.3.3.0¹,¹⁴.0²,¹¹.0⁵,¹⁰.0⁸,¹⁰]henicosan-16-yl 2-methylpropanoate
4,20,21-tris(acetyloxy)-6-(furan-3-yl)-12,19-dihydroxy-5,11,15-trimethyl-3-oxo-9,17-dioxahexacyclo[13.3.3.0¹,¹⁴.0²,¹¹.0⁵,¹⁰.0⁸,¹⁰]henicosan-16-yl 2-methylpropanoate
(2s,3r,7s,9s,11r,15r,22s,23s,24r)-13,14,25-tris(acetyloxy)-3,22-dihydroxy-11,15,17,22,23-pentamethyl-4,21-dioxo-8,20-dioxaheptacyclo[13.10.0.0²,¹².0⁵,¹¹.0⁷,⁹.0¹⁶,²⁴.0¹⁹,²³]pentacos-18-en-10-yl acetate
(2s,3r,7s,9s,11r,15r,22s,23s,24r)-13,14,25-tris(acetyloxy)-3,22-dihydroxy-11,15,17,22,23-pentamethyl-4,21-dioxo-8,20-dioxaheptacyclo[13.10.0.0²,¹².0⁵,¹¹.0⁷,⁹.0¹⁶,²⁴.0¹⁹,²³]pentacos-18-en-10-yl acetate
(1s,2r,4r,5s,6r,8s,10r,11s,12s,14r,15r,16s,19r,20s,21r)-4,19,21-tris(acetyloxy)-6-(furan-3-yl)-12,20-dihydroxy-5,11,15-trimethyl-3-oxo-9,17-dioxahexacyclo[13.3.3.0¹,¹⁴.0²,¹¹.0⁵,¹⁰.0⁸,¹⁰]henicosan-16-yl 2-methylpropanoate
(1s,2r,4r,5s,6r,8s,10r,11s,12s,14r,15r,16s,19r,20s,21r)-4,19,21-tris(acetyloxy)-6-(furan-3-yl)-12,20-dihydroxy-5,11,15-trimethyl-3-oxo-9,17-dioxahexacyclo[13.3.3.0¹,¹⁴.0²,¹¹.0⁵,¹⁰.0⁸,¹⁰]henicosan-16-yl 2-methylpropanoate
(1s,2s,4s,5s,6r,8s,10r,11s,12s,14r,15r,16s,19s,20r,21r)-4,20,21-tris(acetyloxy)-6-(furan-3-yl)-12,19-dihydroxy-5,11,15-trimethyl-3-oxo-9,17-dioxahexacyclo[13.3.3.0¹,¹⁴.0²,¹¹.0⁵,¹⁰.0⁸,¹⁰]henicosan-16-yl 2-methylpropanoate
(1s,2s,4s,5s,6r,8s,10r,11s,12s,14r,15r,16s,19s,20r,21r)-4,20,21-tris(acetyloxy)-6-(furan-3-yl)-12,19-dihydroxy-5,11,15-trimethyl-3-oxo-9,17-dioxahexacyclo[13.3.3.0¹,¹⁴.0²,¹¹.0⁵,¹⁰.0⁸,¹⁰]henicosan-16-yl 2-methylpropanoate
13,14,25-tris(acetyloxy)-3,22-dihydroxy-11,15,17,22,23-pentamethyl-4,21-dioxo-8,20-dioxaheptacyclo[13.10.0.0²,¹².0⁵,¹¹.0⁷,⁹.0¹⁶,²⁴.0¹⁹,²³]pentacos-18-en-10-yl acetate
13,14,25-tris(acetyloxy)-3,22-dihydroxy-11,15,17,22,23-pentamethyl-4,21-dioxo-8,20-dioxaheptacyclo[13.10.0.0²,¹².0⁵,¹¹.0⁷,⁹.0¹⁶,²⁴.0¹⁹,²³]pentacos-18-en-10-yl acetate
4,19,20-tris(acetyloxy)-6-(furan-3-yl)-12,21-dihydroxy-5,11,15-trimethyl-3-oxo-9,17-dioxahexacyclo[13.3.3.0¹,¹⁴.0²,¹¹.0⁵,¹⁰.0⁸,¹⁰]henicosan-16-yl 2-methylpropanoate
4,19,20-tris(acetyloxy)-6-(furan-3-yl)-12,21-dihydroxy-5,11,15-trimethyl-3-oxo-9,17-dioxahexacyclo[13.3.3.0¹,¹⁴.0²,¹¹.0⁵,¹⁰.0⁸,¹⁰]henicosan-16-yl 2-methylpropanoate
(1s,2r,4r,5s,6r,8s,10r,11s,12s,14r,15r,16s,19r,20s,21r)-4,20,21-tris(acetyloxy)-6-(furan-3-yl)-12,19-dihydroxy-5,11,15-trimethyl-3-oxo-9,17-dioxahexacyclo[13.3.3.0¹,¹⁴.0²,¹¹.0⁵,¹⁰.0⁸,¹⁰]henicosan-16-yl 2-methylpropanoate
(1s,2r,4r,5s,6r,8s,10r,11s,12s,14r,15r,16s,19r,20s,21r)-4,20,21-tris(acetyloxy)-6-(furan-3-yl)-12,19-dihydroxy-5,11,15-trimethyl-3-oxo-9,17-dioxahexacyclo[13.3.3.0¹,¹⁴.0²,¹¹.0⁵,¹⁰.0⁸,¹⁰]henicosan-16-yl 2-methylpropanoate
(1s,2r,3r,7s,9s,10r,11s,12s,14s,15r,16s,17s,22s,23s,24s,25r)-3,14,25-tris(acetyloxy)-5,22-dihydroxy-11,15,17,22,23-pentamethyl-4,21-dioxo-8,20-dioxaheptacyclo[13.10.0.0²,¹².0⁵,¹¹.0⁷,⁹.0¹⁶,²⁴.0¹⁹,²³]pentacos-18-en-10-yl acetate
(1s,2r,3r,7s,9s,10r,11s,12s,14s,15r,16s,17s,22s,23s,24s,25r)-3,14,25-tris(acetyloxy)-5,22-dihydroxy-11,15,17,22,23-pentamethyl-4,21-dioxo-8,20-dioxaheptacyclo[13.10.0.0²,¹².0⁵,¹¹.0⁷,⁹.0¹⁶,²⁴.0¹⁹,²³]pentacos-18-en-10-yl acetate
(1s,2s,4r,5s,7s,9s,10r,11s,12s,13s,14r,15r,16s,17s,22r,23s,25r)-4,13,14-tris(acetyloxy)-22,25-dihydroxy-11,15,17,22,23-pentamethyl-3,21-dioxo-8,20-dioxaheptacyclo[13.10.0.0²,¹².0⁵,¹¹.0⁷,⁹.0¹⁶,²⁴.0¹⁹,²³]pentacos-18-en-10-yl acetate
(1s,2s,4r,5s,7s,9s,10r,11s,12s,13s,14r,15r,16s,17s,22r,23s,25r)-4,13,14-tris(acetyloxy)-22,25-dihydroxy-11,15,17,22,23-pentamethyl-3,21-dioxo-8,20-dioxaheptacyclo[13.10.0.0²,¹².0⁵,¹¹.0⁷,⁹.0¹⁶,²⁴.0¹⁹,²³]pentacos-18-en-10-yl acetate
(1r,2s,3s,4r,6s,8s,10s,11r,12r,13s,14s,15r,16r,17s,18r,21s,22s,25r)-4,14,15-tris(acetyloxy)-22-hydroxy-12,16,18,21,22-pentamethyl-5,20,23-trioxo-9,24-dioxaheptacyclo[15.7.1.0²,¹⁶.0³,¹³.0⁶,¹².0⁸,¹⁰.0²¹,²⁵]pentacosan-11-yl acetate
(1r,2s,3s,4r,6s,8s,10s,11r,12r,13s,14s,15r,16r,17s,18r,21s,22s,25r)-4,14,15-tris(acetyloxy)-22-hydroxy-12,16,18,21,22-pentamethyl-5,20,23-trioxo-9,24-dioxaheptacyclo[15.7.1.0²,¹⁶.0³,¹³.0⁶,¹².0⁸,¹⁰.0²¹,²⁵]pentacosan-11-yl acetate
5,16-bis(acetyloxy)-13-(furan-3-yl)-11-hydroxy-7-(2-methoxy-2-oxoethyl)-6,6,8,12-tetramethyl-17-methylidene-9,15-dioxo-2,14-dioxatetracyclo[8.6.1.0¹,¹².0³,⁸]heptadecan-4-yl 2-methylbutanoate
5,16-bis(acetyloxy)-13-(furan-3-yl)-11-hydroxy-7-(2-methoxy-2-oxoethyl)-6,6,8,12-tetramethyl-17-methylidene-9,15-dioxo-2,14-dioxatetracyclo[8.6.1.0¹,¹².0³,⁸]heptadecan-4-yl 2-methylbutanoate
(1s,2r,4r,5r,6s,8r,10s,11s,12r,14r,15r,16r,19r,20r,21s)-4,20,21-tris(acetyloxy)-6-(furan-3-yl)-12,19-dihydroxy-5,11,15-trimethyl-3-oxo-9,17-dioxahexacyclo[13.3.3.0¹,¹⁴.0²,¹¹.0⁵,¹⁰.0⁸,¹⁰]henicosan-16-yl 2-methylpropanoate
(1s,2r,4r,5r,6s,8r,10s,11s,12r,14r,15r,16r,19r,20r,21s)-4,20,21-tris(acetyloxy)-6-(furan-3-yl)-12,19-dihydroxy-5,11,15-trimethyl-3-oxo-9,17-dioxahexacyclo[13.3.3.0¹,¹⁴.0²,¹¹.0⁵,¹⁰.0⁸,¹⁰]henicosan-16-yl 2-methylpropanoate
(1s,2s,4r,5s,7s,9s,10r,11s,12s,13s,14r,15r,16s,17s,22s,23s,24r,25r)-4,13,14-tris(acetyloxy)-22,25-dihydroxy-11,15,17,22,23-pentamethyl-3,21-dioxo-8,20-dioxaheptacyclo[13.10.0.0²,¹².0⁵,¹¹.0⁷,⁹.0¹⁶,²⁴.0¹⁹,²³]pentacos-18-en-10-yl acetate
(1s,2s,4r,5s,7s,9s,10r,11s,12s,13s,14r,15r,16s,17s,22s,23s,24r,25r)-4,13,14-tris(acetyloxy)-22,25-dihydroxy-11,15,17,22,23-pentamethyl-3,21-dioxo-8,20-dioxaheptacyclo[13.10.0.0²,¹².0⁵,¹¹.0⁷,⁹.0¹⁶,²⁴.0¹⁹,²³]pentacos-18-en-10-yl acetate
(1s,3r,4r,5r,7s,8r,10r,11s,12s,13s,16s)-5,16-bis(acetyloxy)-13-(furan-3-yl)-11-hydroxy-7-(2-methoxy-2-oxoethyl)-6,6,8,12-tetramethyl-17-methylidene-9,15-dioxo-2,14-dioxatetracyclo[8.6.1.0¹,¹².0³,⁸]heptadecan-4-yl (2r)-2-methylbutanoate
(1s,3r,4r,5r,7s,8r,10r,11s,12s,13s,16s)-5,16-bis(acetyloxy)-13-(furan-3-yl)-11-hydroxy-7-(2-methoxy-2-oxoethyl)-6,6,8,12-tetramethyl-17-methylidene-9,15-dioxo-2,14-dioxatetracyclo[8.6.1.0¹,¹².0³,⁸]heptadecan-4-yl (2r)-2-methylbutanoate
(1s,3r,4r,5r,7s,8r,10r,11s,12s,13s,16s)-5,16-bis(acetyloxy)-13-(furan-3-yl)-11-hydroxy-7-(2-methoxy-2-oxoethyl)-6,6,8,12-tetramethyl-17-methylidene-9,15-dioxo-2,14-dioxatetracyclo[8.6.1.0¹,¹².0³,⁸]heptadecan-4-yl 2-methylbutanoate
(1s,3r,4r,5r,7s,8r,10r,11s,12s,13s,16s)-5,16-bis(acetyloxy)-13-(furan-3-yl)-11-hydroxy-7-(2-methoxy-2-oxoethyl)-6,6,8,12-tetramethyl-17-methylidene-9,15-dioxo-2,14-dioxatetracyclo[8.6.1.0¹,¹².0³,⁸]heptadecan-4-yl 2-methylbutanoate
(1r,2s,3s,4r,6s,8s,10s,11r,12r,13s,14s,15r,16r,17s,18r,21s,22s,25s)-4,14,15-tris(acetyloxy)-22-hydroxy-12,16,18,21,22-pentamethyl-5,20,23-trioxo-9,24-dioxaheptacyclo[15.7.1.0²,¹⁶.0³,¹³.0⁶,¹².0⁸,¹⁰.0²¹,²⁵]pentacosan-11-yl acetate
(1r,2s,3s,4r,6s,8s,10s,11r,12r,13s,14s,15r,16r,17s,18r,21s,22s,25s)-4,14,15-tris(acetyloxy)-22-hydroxy-12,16,18,21,22-pentamethyl-5,20,23-trioxo-9,24-dioxaheptacyclo[15.7.1.0²,¹⁶.0³,¹³.0⁶,¹².0⁸,¹⁰.0²¹,²⁵]pentacosan-11-yl acetate
(1s,2r,4r,5s,6r,8s,10r,11s,12s,14r,15r,16s,19r,20r,21r)-4,19,20-tris(acetyloxy)-6-(furan-3-yl)-12,21-dihydroxy-5,11,15-trimethyl-3-oxo-9,17-dioxahexacyclo[13.3.3.0¹,¹⁴.0²,¹¹.0⁵,¹⁰.0⁸,¹⁰]henicosan-16-yl 2-methylpropanoate
(1s,2r,4r,5s,6r,8s,10r,11s,12s,14r,15r,16s,19r,20r,21r)-4,19,20-tris(acetyloxy)-6-(furan-3-yl)-12,21-dihydroxy-5,11,15-trimethyl-3-oxo-9,17-dioxahexacyclo[13.3.3.0¹,¹⁴.0²,¹¹.0⁵,¹⁰.0⁸,¹⁰]henicosan-16-yl 2-methylpropanoate
