864 -OEChem-12090815012D 26 26 0 1 0 0 0 0 0999 V2000 2.8090 0.9632 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 1.5510 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 7.0949 -2.3105 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.6302 -0.6632 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.6180 1.5510 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 4.5691 1.2420 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3090 2.5021 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7770 0.2638 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7281 -0.0452 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3090 2.5021 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9360 -1.0233 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8870 -1.3323 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7510 0.7115 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1887 1.2636 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6554 1.8560 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9155 2.6310 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2442 3.1187 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1574 0.2422 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6907 -0.3501 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3477 -0.0235 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8144 0.5688 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3738 3.1187 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7026 2.6310 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3164 -1.0450 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8497 -1.6373 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.6846 -2.5021 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 5 1 0 0 0 0 2 10 1 0 0 0 0 3 12 1 0 0 0 0 3 26 1 0 0 0 0 4 12 2 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 5 13 1 0 0 0 0 6 8 1 0 0 0 0 6 14 1 0 0 0 0 6 15 1 0 0 0 0 7 10 1 0 0 0 0 7 16 1 0 0 0 0 7 17 1 0 0 0 0 8 9 1 0 0 0 0 8 18 1 0 0 0 0 8 19 1 0 0 0 0 9 11 1 0 0 0 0 9 20 1 0 0 0 0 9 21 1 0 0 0 0 10 22 1 0 0 0 0 10 23 1 0 0 0 0 11 12 1 0 0 0 0 11 24 1 0 0 0 0 11 25 1 0 0 0 0 M END > 1 > 864 > 1 > 150 > 2 > 1 > 5 > AAADccBwMABgAAAAAAAAAAAAAAAAASAAAAAAAAAAAAAAAAAAAAAAGgQACAAACACEwACACAAAAgAIAACQCAAAAAAAAAAAAAEAAAAAABIAAAAAQAAEAAAAAAGIyKCAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAA== > 5-(dithiolan-3-yl)pentanoic acid > 5-(3-dithiolanyl)pentanoic acid > 5-(dithiolan-3-yl)pentanoic acid > 5-(1,2-dithiolan-3-yl)pentanoic acid > 5-(dithiolan-3-yl)valeric acid > InChI=1/C8H14O2S2/c9-8(10)4-2-1-3-7-5-6-11-12-7/h7H,1-6H2,(H,9,10)/f/h9H > 2.1 > 206.043521 > C8H14O2S2 > 206.32556 > C1CSSC1CCCCC(=O)O > C1CSSC1CCCCC(=O)O > 37.3 > 206.043521 > 0 > 12 > 0 > 1 > 0 > 0 > 0 > 1 > 1 > 2913 > 1 > BioCyc > LIPOIC-ACID > TYPES - Coenzymes Is a reactant or product of enzyme EC 1.8.1.4 > 1,2-dithiolane-3-pentanoic acid 5-(1,2-dithiolan-3-yl)-pentanoate 62-46-4 LIPOIC-ACID alpha-liponic acid lipoate lipoic acid > 62-46-4 > LIPOIC-ACID > 7639702 8002607 8206909 > 118673 121086 129043 129056 417041 493858 493871 585424 2506963 2506964 3402005 4139825 5542400 16128107 16128108 16128109 16128701 16128702 16130805 16130806 16130807 16132203 22219207 22219208 47168816 47168817 > http://biocyc.org > http://biocyc.org/META/NEW-IMAGE?type=COMPOUND&object=LIPOIC%2DACID > 864 1 > 5 13 3 $$$$