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tar_600MHz_05.tar.gz | 11-Oct-2012 04:48 | 368M | ||
tar_600MHz_05.list | 11-Oct-2012 03:14 | 135 | ||
tar_600MHz_04.tar.gz | 11-Oct-2012 04:44 | 238M | ||
tar_600MHz_04.list | 11-Oct-2012 03:13 | 114 | ||
tar_600MHz_03.tar.gz | 11-Oct-2012 03:54 | 239M | ||
tar_600MHz_03.list | 11-Oct-2012 03:13 | 131 | ||
tar_600MHz_02.tar.gz | 11-Oct-2012 03:38 | 281M | ||
tar_600MHz_02.list | 11-Oct-2012 03:12 | 131 | ||
tar_600MHz_01.tar.gz | 11-Oct-2012 03:30 | 270M | ||
tar_600MHz_01.list | 11-Oct-2012 03:12 | 116 | ||
tar_96.tar.gz | 27-Feb-2013 05:55 | 290M | ||
tar_96.list | 27-Feb-2013 05:55 | 136 | ||
tar_95.tar.gz | 22-Feb-2013 05:39 | 127M | ||
tar_95.list | 27-Feb-2013 01:09 | 127 | ||
tar_94.tar.gz | 15-Jan-2013 03:42 | 243M | ||
tar_94.list | 15-Jan-2013 03:46 | 128 | ||
tar_93.tar.gz | 11-Oct-2012 02:56 | 114M | ||
tar_93.list | 11-Oct-2012 02:26 | 82 | ||
tar_92.tar.gz | 02-Nov-2012 03:09 | 279M | ||
tar_92.list | 11-Oct-2012 02:26 | 149 | ||
tar_91.tar.gz | 11-Oct-2012 02:49 | 433M | ||
tar_91.list | 11-Oct-2012 02:25 | 174 | ||
tar_90.tar.gz | 11-Oct-2012 02:30 | 372M | ||
tar_90.list | 11-Oct-2012 02:29 | 183 | ||
tar_89.tar.gz | 11-Oct-2012 02:20 | 165M | ||
tar_89.list | 11-Oct-2012 01:49 | 178 | ||
tar_88.tar.gz | 29-Aug-2012 02:33 | 415M | ||
tar_88.list | 29-Aug-2012 02:33 | 183 | ||
tar_87.tar.gz | 03-Aug-2012 03:52 | 120M | ||
tar_87.list | 03-Aug-2012 03:52 | 62 | ||
tar_86.tar.gz | 28-Jul-2012 04:31 | 433M | ||
tar_86.list | 28-Jul-2012 04:31 | 164 | ||
tar_85.tar.gz | 13-Jun-2012 05:02 | 304M | ||
tar_85.list | 13-Jun-2012 05:00 | 133 | ||
tar_84.tar.gz | 08-Jun-2012 04:45 | 289M | ||
tar_84.list | 08-Jun-2012 04:39 | 127 | ||
tar_83.tar.gz | 18-May-2012 05:13 | 294M | ||
tar_83.list | 18-May-2012 05:13 | 140 | ||
tar_82.tar.gz | 02-May-2012 01:08 | 180M | ||
tar_82.list | 02-May-2012 01:08 | 378 | ||
tar_81.tar.gz | 26-Apr-2012 02:43 | 447M | ||
tar_81.list | 26-Apr-2012 02:43 | 178 | ||
tar_80.tar.gz | 14-Apr-2012 02:41 | 231M | ||
tar_80.list | 14-Apr-2012 02:41 | 110 | ||
tar_79.tar.gz | 13-Apr-2012 04:35 | 597K | ||
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tar_78.tar.gz | 28-Mar-2012 05:32 | 410M | ||
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tar_77.tar.gz | 15-Mar-2012 02:09 | 307M | ||
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tar_76.tar.gz | 26-Sep-2012 06:50 | 193M | ||
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tar_75.tar.gz | 18-Feb-2012 06:32 | 286M | ||
tar_75.list | 18-Feb-2012 06:32 | 145 | ||
tar_74.tar.gz | 06-Dec-2011 02:48 | 371M | ||
tar_74.list | 06-Dec-2011 02:41 | 259 | ||
tar_73.tar.gz | 17-Nov-2011 05:02 | 232M | ||
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tar_72.tar.gz | 15-Nov-2011 06:37 | 231M | ||
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tar_71.tar.gz | 15-Nov-2011 06:32 | 132M | ||
tar_71.list | 15-Nov-2011 06:32 | 79 | ||
tar_70.tar.gz | 26-Sep-2012 05:55 | 182M | ||
tar_70.list | 26-Sep-2012 05:54 | 143 | ||
tar_69.tar.gz | 02-Nov-2011 05:09 | 235M | ||
tar_69.list | 02-Nov-2011 05:09 | 202 | ||
tar_68.tar.gz | 26-Sep-2012 05:52 | 167M | ||
tar_68.list | 26-Sep-2012 05:51 | 121 | ||
tar_67.tar.gz | 29-Oct-2011 01:32 | 133M | ||
tar_67.list | 29-Oct-2011 01:41 | 103 | ||
tar_65.tar.gz | 09-Nov-2011 06:49 | 103M | ||
tar_65.list | 09-Nov-2011 06:49 | 57 | ||
tar_64.tar.gz | 22-Sep-2010 06:09 | 143M | ||
tar_64.list | 22-Sep-2010 06:09 | 109 | ||
tar_63.tar.gz | 11-Mar-2011 07:03 | 179M | ||
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tar_62.tar.gz | 16-Sep-2010 02:42 | 197M | ||
tar_62.list | 03-Sep-2010 05:02 | 188 | ||
tar_61.tar.gz | 26-Sep-2012 05:47 | 501M | ||
tar_61.list | 26-Sep-2012 05:46 | 261 | ||
tar_60.tar.gz | 19-Oct-2010 05:23 | 320M | ||
tar_60.list | 19-Oct-2010 05:23 | 222 | ||
tar_59.tar.gz | 21-Oct-2010 00:35 | 178M | ||
tar_59.list | 21-Oct-2010 00:30 | 97 | ||
tar_58.tar.gz | 10-Aug-2010 03:57 | 170M | ||
tar_58.list | 10-Aug-2010 03:56 | 119 | ||
tar_57.tar.gz | 26-May-2012 04:41 | 117M | ||
tar_57.list | 26-May-2012 04:33 | 81 | ||
tar_56.tar.gz | 08-Sep-2010 01:22 | 394M | ||
tar_56.list | 08-Sep-2010 01:21 | 270 | ||
tar_55.tar.gz | 11-Mar-2011 06:56 | 384M | ||
tar_55.list | 11-Mar-2011 06:56 | 259 | ||
tar_54.tar.gz | 10-Aug-2010 03:41 | 316M | ||
tar_54.list | 10-Aug-2010 03:41 | 287 | ||
tar_53.tar.gz | 17-Aug-2010 04:46 | 179M | ||
tar_53.list | 17-Aug-2010 04:18 | 148 | ||
tar_52.tar.gz | 08-Sep-2010 01:12 | 271M | ||
tar_52.list | 08-Sep-2010 01:12 | 195 | ||
tar_51.tar.gz | 08-Sep-2010 01:09 | 284M | ||
tar_51.list | 08-Sep-2010 01:08 | 192 | ||
tar_50.tar.gz | 08-Sep-2010 01:05 | 293M | ||
tar_50.list | 08-Sep-2010 01:05 | 212 | ||
tar_49.tar.gz | 08-Sep-2010 01:02 | 268M | ||
tar_49.list | 08-Sep-2010 01:01 | 174 | ||
tar_48.tar.gz | 30-Jan-2010 02:47 | 212M | ||
tar_48.list | 30-Jan-2010 02:47 | 154 | ||
tar_47.tar.gz | 30-Jan-2010 02:45 | 293M | ||
tar_47.list | 30-Jan-2010 02:45 | 219 | ||
tar_46.tar.gz | 20-Mar-2010 05:21 | 179M | ||
tar_46.list | 20-Mar-2010 05:20 | 107 | ||
tar_45.tar.gz | 20-Mar-2010 05:16 | 316M | ||
tar_45.list | 20-Mar-2010 05:15 | 174 | ||
tar_44.tar.gz | 30-Jan-2010 02:30 | 117M | ||
tar_44.list | 30-Jan-2010 02:30 | 59 | ||
tar_43.tar.gz | 30-Jan-2010 02:25 | 365M | ||
tar_43.list | 30-Jan-2010 02:25 | 169 | ||
tar_42.tar.gz | 16-Nov-2010 06:03 | 474M | ||
tar_42.list | 16-Nov-2010 06:03 | 129 | ||
tar_41.tar.gz | 20-Mar-2010 05:06 | 829M | ||
tar_41.list | 20-Mar-2010 05:05 | 348 | ||
tar_40.tar | 26-Sep-2012 05:06 | 17M | ||
tar_40.list | 26-Sep-2012 05:04 | 19 | ||
tar_39.tar.gz | 20-Mar-2010 04:52 | 1.0G | ||
tar_39.list | 20-Mar-2010 04:51 | 309 | ||
tar_38.tar.gz | 10-Aug-2010 23:50 | 836M | ||
tar_38.list | 10-Aug-2010 23:44 | 491 | ||
tar_37.tar.gz | 20-Mar-2010 04:34 | 904M | ||
tar_37.list | 20-Mar-2010 04:33 | 304 | ||
tar_36.tar.gz | 11-Aug-2010 01:31 | 1.2G | ||
tar_36.list | 11-Aug-2010 01:20 | 492 | ||
tar_35.tar.gz | 20-Mar-2010 03:56 | 435M | ||
tar_35.list | 20-Mar-2010 03:55 | 138 | ||
tar_34.tar.gz | 20-Mar-2010 05:38 | 507M | ||
tar_34.list | 20-Mar-2010 05:38 | 222 | ||
tar_33.tar.gz | 11-Aug-2010 03:41 | 427M | ||
tar_33.list | 11-Aug-2010 02:41 | 157 | ||
tar_32.tar.gz | 11-Mar-2011 06:53 | 426M | ||
tar_32.list | 11-Mar-2011 06:53 | 99 | ||
tar_31.tar.gz | 11-Aug-2010 03:39 | 367M | ||
tar_31.list | 11-Aug-2010 03:20 | 110 | ||
tar_30.tar.gz | 11-Aug-2010 03:36 | 424M | ||
tar_30.list | 11-Aug-2010 03:08 | 119 | ||
tar_29.tar.gz | 11-Mar-2011 06:49 | 608M | ||
tar_29.list | 11-Mar-2011 06:49 | 137 | ||
tar_28.tar.gz | 11-Aug-2010 03:07 | 513M | ||
tar_28.list | 11-Aug-2010 03:03 | 182 | ||
tar_27.tar.gz | 20-Mar-2010 04:06 | 937M | ||
tar_27.list | 20-Mar-2010 04:05 | 350 | ||
tar_26.tar.gz | 20-Mar-2010 03:45 | 1.4G | ||
tar_26.list | 20-Mar-2010 03:44 | 431 | ||
tar_25.tar.gz | 11-Mar-2011 06:42 | 1.0G | ||
tar_25.list | 11-Mar-2011 06:42 | 237 | ||
tar_24.tar.gz | 09-Dec-2010 04:17 | 1.5G | ||
tar_24.list | 09-Dec-2010 04:16 | 376 | ||
tar_23.tar.gz | 09-Nov-2011 06:40 | 1.5G | ||
tar_23.list | 09-Nov-2011 06:39 | 419 | ||
tar_22.tar.gz | 11-Aug-2010 00:14 | 1.6G | ||
tar_22.list | 11-Aug-2010 00:13 | 651 | ||
tar_21.tar.gz | 21-Sep-2012 01:36 | 2.1G | ||
tar_21.list | 21-Sep-2012 01:32 | 661 | ||
tar_20.tar.gz | 20-Mar-2010 01:55 | 1.6G | ||
tar_20.list | 20-Mar-2010 01:54 | 656 | ||
tar_19.tar.gz | 20-Mar-2010 01:38 | 1.1G | ||
tar_19.list | 20-Mar-2010 01:37 | 485 | ||
tar_18.tar.gz | 10-Aug-2010 23:28 | 1.1G | ||
tar_18.list | 10-Aug-2010 23:28 | 509 | ||
tar_17.tar.gz | 09-Nov-2011 06:27 | 1.4G | ||
tar_17.list | 09-Nov-2011 06:26 | 524 | ||
tar_16.tar.gz | 20-Mar-2010 00:45 | 1.5G | ||
tar_16.list | 20-Mar-2010 00:44 | 723 | ||
tar_15.tar.gz | 20-Mar-2010 00:32 | 576M | ||
tar_15.list | 20-Mar-2010 00:32 | 223 | ||
tar_14.tar.gz | 20-Mar-2010 00:28 | 290M | ||
tar_14.list | 20-Mar-2010 00:27 | 144 | ||
tar_13.tar.gz | 20-Mar-2010 00:24 | 286M | ||
tar_13.list | 20-Mar-2010 00:24 | 107 | ||
tar_12.tar.gz | 10-Aug-2010 23:22 | 390M | ||
tar_12.list | 10-Aug-2010 23:22 | 557 | ||
tar_11.tar.gz | 09-Nov-2011 06:19 | 449M | ||
tar_11.list | 09-Nov-2011 06:19 | 594 | ||
tar_10.tar.gz | 15-Oct-2012 23:57 | 418M | ||
tar_10.list | 15-Oct-2012 23:52 | 495 | ||
tar_09.tar.gz | 09-Nov-2011 06:10 | 341M | ||
tar_09.list | 09-Nov-2011 06:10 | 569 | ||
tar_08.tar.gz | 09-Nov-2011 06:06 | 334M | ||
tar_08.list | 09-Nov-2011 06:06 | 609 | ||
tar_07.tar.gz | 09-Nov-2011 06:02 | 393M | ||
tar_07.list | 09-Nov-2011 06:02 | 542 | ||
tar_06.tar.gz | 09-Nov-2011 05:58 | 430M | ||
tar_06.list | 09-Nov-2011 05:58 | 642 | ||
tar_05.tar.gz | 09-Nov-2011 05:52 | 689M | ||
tar_05.list | 09-Nov-2011 05:52 | 623 | ||
tar_04.tar.gz | 09-Nov-2011 05:47 | 405M | ||
tar_04.list | 09-Nov-2011 05:47 | 363 | ||
tar_03.tar.gz | 09-Nov-2011 05:42 | 529M | ||
tar_03.list | 09-Nov-2011 05:42 | 448 | ||
tar_02.tar.gz | 09-Nov-2011 05:37 | 493M | ||
tar_02.list | 09-Nov-2011 05:37 | 611 | ||
tar_01.tar.gz | 09-Nov-2011 23:49 | 651M | ||
tar_01.list | 09-Nov-2011 23:47 | 701 | ||
supplemental_proton.tar.gz | 11-Oct-2012 00:24 | 12M | ||
supplemental_proton.list | 11-Oct-2012 00:19 | 81 | ||
jres_tar_08.tar.gz | 19-Feb-2013 05:32 | 311M | ||
jres_tar_08.list | 19-Feb-2013 05:32 | 244 | ||
jres_tar_07.tar.gz | 21-Sep-2012 01:16 | 287M | ||
jres_tar_07.list | 21-Sep-2012 01:09 | 204 | ||
jres_tar_06.tar.gz | 21-Sep-2012 01:16 | 285M | ||
jres_tar_06.list | 21-Sep-2012 01:04 | 211 | ||
jres_tar_05.tar.gz | 21-Sep-2012 01:16 | 265M | ||
jres_tar_05.list | 21-Sep-2012 00:58 | 222 | ||
jres_tar_04.tar.gz | 21-Sep-2012 01:16 | 273M | ||
jres_tar_04.list | 21-Sep-2012 00:52 | 208 | ||
jres_tar_03.tar.gz | 21-Sep-2012 01:15 | 273M | ||
jres_tar_03.list | 21-Sep-2012 00:45 | 243 | ||
jres_tar_02.tar.gz | 21-Sep-2012 01:15 | 270M | ||
jres_tar_02.list | 21-Sep-2012 00:38 | 195 | ||
jres_tar_01.tar.gz | 21-Sep-2012 01:15 | 268M | ||
jres_tar_01.list | 21-Sep-2012 00:31 | 215 | ||
The Metabolomics data that reside at BMRB have been archived in tar files and compressed for easier downloads. Due to the large amount of binary data, the compression factor is not incredibly large. These are large files. The data in these files are the same as that contained in the metabolomics/standards directory on the BMRB ftp site. The basic directory structure is as follows: MOLECULE_NAME/ | | |____nmr/ | |____bmse[num]/ (experimental data) | | |____1H/ (1H raw data) | | |____HH_TOCSY/ (HH_TOCSY raw data) | | |____1H3C/ (13C raw data) | | |____DEPT_90/ (DEPT_90 raw data) | | |____DEPT_135/ (DEPT_135 raw data) | | |____1H_13C_HSQC/ (1H_13C_HSQC raw data) | | |____index (text file with experiment conditions) | | |____bmse[num].str (text file in STAR format with additional | | molecular information) | | | |____bmst[num]/ (theoretical data) | | |____bmst[num].str | | |____[name]/ | | | | | |____[name].mol | | |____[name]_opt.pdb | | |____[name].go3 | | |____[name].go3.out | | |____[name].go3.shifts | | | |____bms[etc.]/ | | | |____lit/ |____<pubchem_id_1>.sdf |____<pubchem_id_1>.png |____<pubchem_id_1>.mol |____<pubchem_id_2>.sdf |____...etc... Most of the literature comes from the PubChem Substance list and is named after the PubChem ID that it came from. For the cases where we could not find all of the information we needed in a PubChem file, We obtained it from another source and named it something else. Each tar file has a similarly named list that says which molecular data it contains. HISTORY: 2 May 2006 - Initial collection listed in tar_01.list through tar_10.list was posted to the ftp site. 18 Oct 2006 - Additional standards, listed in tar_11.list and tar_12.list were added 7 Jun 2007 - Standards with questionable data and standards with only theoretical data were removed from the collection. These were: tar_01.list:2_deoxy_D_Ribose tar_01.list:3_acetylphenylboronic_acid tar_02.list:D_erythrose_4_phosphate tar_02.list:D_glucuronolactone tar_03.list:D_ribose tar_03.list:D_ribose_5_phosphate tar_03.list:D_ribulose_1_5_biphosphate tar_03.list:D_talose tar_04.list:L_erythrose tar_05.list:L_threose tar_06.list:acetoacetic_Acid tar_07.list:dihydroxyacetone_phosphate tar_09.list:phenylpyruvic_acid tar_09.list:pyruvic_acid tar_10.list:xanthurenic_acid