Ketcher 10091513542D 1 1.00000 0.00000 0 56 55 0 1 0 999 V2000 7.2900 -9.4806 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.4245 -8.9808 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5588 -9.4806 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.3243 -7.4815 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4245 -7.9813 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3243 -6.4821 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.5933 -6.4821 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.4587 -5.9823 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1900 -4.9828 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8246 -3.6176 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3243 -4.4831 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8241 -3.6176 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4587 -4.9828 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5932 -4.4831 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.0554 -4.4831 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.0543 -4.4831 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.0549 -3.4837 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.0549 -5.4826 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.0549 -4.4831 0.0000 P 0 0 0 0 0 0 0 0 0 0 0 0 11.9199 -3.9834 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.7854 -4.4831 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.6509 -3.9834 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.5165 -4.4831 0.0000 * 0 0 0 0 0 0 0 0 0 0 0 0 12.7854 -5.4826 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 13.6509 -2.9839 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.9199 -5.9823 0.0000 * 0 0 0 0 0 0 0 0 0 0 0 0 7.2898 -10.4799 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1555 -10.9797 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1555 -11.9792 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 9.0210 -12.4789 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.8865 -11.9792 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0210 -13.4784 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.7520 -12.4790 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.6176 -11.9792 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.4832 -12.4791 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.3488 -11.9794 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.2143 -12.4791 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.0798 -10.9800 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.9454 -10.4802 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.8108 -10.9800 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.6764 -10.4803 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.6763 -9.4810 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.8107 -8.9811 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.9451 -9.4810 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.0795 -8.9812 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.2140 -9.4810 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.3485 -8.9812 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 19.4074 -9.4810 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 19.4074 -10.4803 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.5418 -8.9811 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.5418 -10.9800 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.0798 -11.9795 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.4829 -9.4809 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.6174 -8.9811 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.7517 -9.4807 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.8862 -8.9809 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5 2 1 0 0 0 2 1 1 0 0 0 2 3 2 0 0 0 4 6 1 0 0 0 8 6 1 0 0 0 5 4 1 0 0 0 8 7 2 0 0 0 8 13 1 0 0 0 13 11 1 0 0 0 11 9 1 0 0 0 9 15 1 0 0 0 11 10 1 0 0 0 11 12 1 0 0 0 13 14 1 6 0 0 15 19 1 0 0 0 19 16 1 0 0 0 19 17 2 0 0 0 19 18 1 0 0 0 16 20 1 0 0 0 20 21 1 0 0 0 21 22 1 0 0 0 22 23 1 0 0 0 21 24 1 1 0 0 22 25 2 0 0 0 24 26 1 0 0 0 1 27 1 0 0 0 27 28 1 0 0 0 28 29 1 0 0 0 30 31 1 0 0 0 29 30 1 0 0 0 30 32 2 0 0 0 31 33 2 0 0 0 33 34 1 0 0 0 34 35 1 0 0 0 35 36 1 0 0 0 36 37 1 0 0 0 38 39 1 0 0 0 39 40 1 0 0 0 40 41 1 0 0 0 42 43 1 0 0 0 43 44 1 0 0 0 44 45 1 0 0 0 45 46 1 0 0 0 46 47 1 0 0 0 50 48 1 0 0 0 51 49 1 0 0 0 42 50 1 0 0 0 41 51 1 0 0 0 37 52 2 0 0 0 52 38 1 0 0 0 49 48 1 0 0 0 47 53 1 0 0 0 53 54 1 0 0 0 54 55 1 0 0 0 55 56 1 0 0 0 M CHG 1 18 -1 M END > CHEBI:87859 > O-[S-(2E,7Z-hexacosadienoylpantetheine)-4'-phosphoryl]-L-serine(1-) residue > An O-[S-(2E)-2-enoylpantetheine-4ʼ-phosphoryl]-L-serine(1−) residue in which the S-acyl group is specified as (2E,5Z)-hexacosadienoyl. > 3 > O-[S-(2E,7Z-hexacosadienoylpantetheine)-4'-phosphoryl]-L-serine residue; (2E,7Z-C26 :2-phosphopantetheine)-L-serine(1-) residue > C40H71N3O9PS > 801.048 > 800.46486 > -1 > N(C(CCNC(=O)[C@@H](C(COP(OC[C@@H](C(*)=O)N*)(=O)[O-])(C)C)O)=O)CCSC(/C=C/CCC/C=C\CCCCCCCCCCCCCCCCCC)=O $$$$