http://metabolomics.jp/mediawiki/index.php?action=history&feed=atom&title=Mol%3ABMMCBZ2Oa021 2026-09-16T23:12:27Z Revision history for this page on the wiki MediaWiki 1.19.1 http://metabolomics.jp/mediawiki/index.php?title=Mol:BMMCBZ2Oa021&diff=178811&oldid=prev 2009-03-14T00:00:00Z

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<p></p> <p><b>New page</b></p><div>&lt;pre&gt;<br /> <br /> Copyright: ARM project http://www.metabolome.jp/<br /> 63 66 0 0 1 0 0 0 0 0999 V2000<br /> 3.9563 -1.2266 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0<br /> 3.6473 -2.1777 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0<br /> 2.6691 -2.3856 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0<br /> 2.0000 -1.6425 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0<br /> 2.3090 -0.6914 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0<br /> 3.2872 -0.4835 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0<br /> 4.9344 -1.4345 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0<br /> 5.1060 -3.7977 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0<br /> 4.7970 -4.7488 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0<br /> 5.4661 -5.4919 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0<br /> 5.1571 -6.4430 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0<br /> 5.2435 -2.3856 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0<br /> 6.0841 -3.5898 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0<br /> 4.1789 -6.6509 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0<br /> 5.8262 -7.1862 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0<br /> 22.2916 -0.4046 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0<br /> 21.4255 0.0954 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0<br /> 21.4255 1.0954 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0<br /> 22.2916 1.5954 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0<br /> 23.1576 1.0954 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0<br /> 23.1576 0.0954 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0<br /> 23.9007 1.7645 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0<br /> 23.4940 2.6781 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0<br /> 22.4995 2.5735 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0<br /> 24.0236 -0.4046 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0<br /> 21.8303 3.3167 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0<br /> 22.0382 4.2948 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0<br /> 21.1722 4.7948 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0<br /> 20.4291 4.1257 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0<br /> 19.4509 4.3336 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0<br /> 22.9518 4.7016 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0<br /> 21.0677 5.7893 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0<br /> 20.8358 3.2122 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0<br /> 18.7818 3.5905 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0<br /> 21.8767 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0 0 0 0 0 0<br /> 10.5454 0.9143 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0<br /> 9.8763 0.1712 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0<br /> 8.8981 0.3791 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0<br /> 8.2290 -0.3641 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0<br /> 7.2509 -0.1562 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0<br /> 6.5817 -0.8993 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0<br /> 5.6036 -0.6914 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0<br /> 13.4799 0.2906 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0<br /> 11.8837 2.4006 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0<br /> 8.5891 1.3301 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0<br /> 16 21 2 0 0 0 0<br /> 16 17 1 0 0 0 0<br /> 17 18 2 0 0 0 0<br /> 18 19 1 0 0 0 0<br /> 20 21 1 0 0 0 0<br /> 20 19 2 0 0 0 0<br /> 24 23 1 0 0 0 0<br /> 23 22 2 0 0 0 0<br /> 22 20 1 0 0 0 0<br /> 19 24 1 0 0 0 0<br /> 21 25 1 0 0 0 0<br /> 29 33 1 6 0 0 0<br /> 28 29 1 0 0 0 0<br /> 26 33 1 6 0 0 0<br /> 28 27 1 0 0 0 0<br /> 26 27 1 0 0 0 0<br /> 29 30 1 0 0 0 0<br /> 30 34 1 0 0 0 0<br /> 26 24 1 0 0 0 0<br /> 34 39 1 0 0 0 0<br /> 39 41 1 0 0 0 0<br /> 39 40 2 0 0 0 0<br /> 39 42 1 0 0 0 0<br /> 46 43 1 0 0 0 0<br /> 43 45 2 0 0 0 0<br /> 43 44 1 0 0 0 0<br /> 46 47 1 0 0 0 0<br /> 43 42 1 0 0 0 0<br /> 47 48 1 0 0 0 0<br /> 48 51 1 0 0 0 0<br /> 48 50 1 0 0 0 0<br /> 48 49 1 0 0 0 0<br /> 51 52 1 0 0 0 0<br /> 51 61 1 1 0 0 0<br /> 52 62 2 0 0 0 0<br /> 52 53 1 0 0 0 0<br /> 53 54 1 0 0 0 0<br /> 54 55 1 0 0 0 0<br /> 55 56 1 0 0 0 0<br /> 56 57 1 0 0 0 0<br /> 56 63 2 0 0 0 0<br /> 57 58 1 0 0 0 0<br /> 58 59 1 0 0 0 0<br /> 59 60 1 0 0 0 0<br /> 27 31 1 1 0 0 0<br /> 28 32 1 1 0 0 0<br /> 36 35 1 0 0 0 0<br /> 35 38 1 0 0 0 0<br /> 35 37 2 0 0 0 0<br /> 32 35 1 0 0 0 0<br /> 6 5 2 0 0 0 0<br /> 6 1 1 0 0 0 0<br /> 1 2 2 0 0 0 0<br /> 2 3 1 0 0 0 0<br /> 3 4 2 0 0 0 0<br /> 4 5 1 0 0 0 0<br /> 7 12 2 0 0 0 0<br /> 1 7 1 0 0 0 0<br /> 7 60 1 0 0 0 0<br /> 9 10 1 0 0 0 0<br /> 11 15 1 0 0 0 0<br /> 11 14 2 0 0 0 0<br /> 10 11 1 0 0 0 0<br /> 8 13 2 0 0 0 0<br /> 9 8 1 0 0 0 0<br /> 2 8 1 0 0 0 0<br /> S SKP 7<br /> ID BMMCBZ2Oa021<br /> NAME 2-Succinyl-benzoyl-CoA<br /> FORMULA C32H44N7O20P3S<br /> EXACTMASS 971.1574<br /> AVERAGEMASS 971.7142<br /> SMILES C(OP(OP(O)(=O)OC[C@@H](O2)[C@@H](OP(O)(O)=O)[C@H]([C@@H]2n(c34)cnc3c(ncn4)N)O)(O)=O)C(C)(C)[C@H](C(=O)NCCC(NCCSC(c(c1C(=O)CCC(O)=O)cccc1)=O)=O)O<br /> KEGG http://www.genome.jp/dbget-bin/www_bget?compound+C03160<br /> M END<br /> &lt;/pre&gt;</div>

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