SMIRKS
[H][O:24][C:23]([C@@:22]([C:21]([O:20][C:18]([C:17]([C:16]([C:15]([C:14]([C:13]([C:12]([C:11]([C:10](=[C:9]([C:8]([C:7]([C:6]([C:5]([C:4]([C:3]([C:2]([C:1]([H:185])([H:186])[H:187])([H:183])[H:184])([H:181])[H:182])([H:179])[H:180])([H:177])[H:178])([H:175])[H:176])([H:173])[H:174])([H:171])[H:172])[H:170])[H:169])([H:167])[H:168])([H:165])[H:166])([H:163])[H:164])([H:161])[H:162])([H:159])[H:160])([H:157])[H:158])([H:155])[H:156])=[O:19])([H:153])[H:154])([O:25][C:26](=[O:27])[C:28]([C:29]([C:30]([C:31]([C:32]([C:33]([C:34]([C:35](=[C:36]([C:37]([C:38]([C:39]([C:40]([C:41]([C:42]([C:43]([C:44]([H:119])([H:120])[H:121])([H:122])[H:123])([H:124])[H:125])([H:126])[H:127])([H:128])[H:129])([H:130])[H:131])([H:132])[H:133])([H:134])[H:135])[H:136])[H:137])([H:138])[H:139])([H:140])[H:141])([H:142])[H:143])([H:144])[H:145])([H:146])[H:147])([H:148])[H:149])([H:150])[H:151])[H:152])([H:117])[H:118].[C:45]([C:46]([C:47]([C:48]([C:49]([C:50]([C:51]([C:52]([C:53](=[C:54]([C:55]([C:56]([C:57]([C:58]([C:59]([C:60]([C:61]([C:62]([C:63]([C:64]([C:65]([C:66](=[O:67])[S:68][C:69]([C:70]([N:71]([C:72](=[O:73])[C:74]([C:75]([N:76]([C:77](=[O:78])[C@:79]([O:80][H:188])([C:81]([C:82]([H:189])([H:190])[H:191])([C:83]([H:192])([H:193])[H:194])[C:84]([O:85][P:86](=[O:87])([O:88][H:195])[O:89][P:90](=[O:91])([O:92][H:196])[O:93][C:94]([C@@:95]1([H:197])[O:96][C@:97]([N:98]2:[C:99]([H:198]):[N:100]:[C:101]3:[C:102]([N:103]([H:199])[H:200]):[N:104]:[C:105]([H:201]):[N:106]:[C:107]:2:3)([H:202])[C@@:108]([O:109][H:203])([H:204])[C@@:110]1([O:111][P:112](=[O:113])([O:114][H:205])[O:115][H:206])[H:207])([H:208])[H:209])([H:210])[H:211])[H:212])[H:213])([H:214])[H:215])([H:216])[H:217])[H:218])([H:219])[H:220])([H:221])[H:222])([H:223])[H:224])([H:225])[H:226])([H:227])[H:228])([H:229])[H:230])([H:231])[H:232])([H:233])[H:234])([H:235])[H:236])([H:237])[H:238])([H:239])[H:240])([H:241])[H:242])([H:243])[H:244])[H:245])[H:246])([H:247])[H:248])([H:249])[H:250])([H:251])[H:252])([H:253])[H:254])([H:255])[H:256])([H:257])[H:258])([H:259])[H:260])([H:261])([H:262])[H:263]>>[C:1]([C:2]([C:3]([C:4]([C:5]([C:6]([C:7]([C:8]([C:9](=[C:10]([C:11]([C:12]([C:13]([C:14]([C:15]([C:16]([C:17]([C:18](=[O:19])[O:20][C:21]([C@:22]([C:23]([O:24][C:66]([C:65]([C:64]([C:63]([C:62]([C:61]([C:60]([C:59]([C:58]([C:57]([C:56]([C:55]([C:54](=[C:53]([C:52]([C:51]([C:50]([C:49]([C:48]([C:47]([C:46]([C:45]([H:261])([H:262])[H:263])([H:259])[H:260])([H:257])[H:258])([H:255])[H:256])([H:253])[H:254])([H:251])[H:252])([H:249])[H:250])([H:247])[H:248])[H:246])[H:245])([H:243])[H:244])([H:241])[H:242])([H:239])[H:240])([H:237])[H:238])([H:235])[H:236])([H:233])[H:234])([H:231])[H:232])([H:229])[H:230])([H:227])[H:228])([H:225])[H:226])([H:223])[H:224])=[O:67])([H:117])[H:118])([O:25][C:26](=[O:27])[C:28]([C:29]([C:30]([C:31]([C:32]([C:33]([C:34]([C:35](=[C:36]([C:37]([C:38]([C:39]([C:40]([C:41]([C:42]([C:43]([C:44]([H:119])([H:120])[H:121])([H:122])[H:123])([H:124])[H:125])([H:126])[H:127])([H:128])[H:129])([H:130])[H:131])([H:132])[H:133])([H:134])[H:135])[H:136])[H:137])([H:138])[H:139])([H:140])[H:141])([H:142])[H:143])([H:144])[H:145])([H:146])[H:147])([H:148])[H:149])([H:150])[H:151])[H:152])([H:153])[H:154])([H:155])[H:156])([H:157])[H:158])([H:159])[H:160])([H:161])[H:162])([H:163])[H:164])([H:165])[H:166])([H:167])[H:168])[H:169])[H:170])([H:171])[H:172])([H:173])[H:174])([H:175])[H:176])([H:177])[H:178])([H:179])[H:180])([H:181])[H:182])([H:183])[H:184])([H:185])([H:186])[H:187].[H][S:68][C:69]([C:70]([N:71]([C:72](=[O:73])[C:74]([C:75]([N:76]([C:77](=[O:78])[C@:79]([O:80][H:188])([C:81]([C:82]([H:189])([H:190])[H:191])([C:83]([H:192])([H:193])[H:194])[C:84]([O:85][P:86](=[O:87])([O:88][H:195])[O:89][P:90](=[O:91])([O:92][H:196])[O:93][C:94]([C@@:95]1([H:197])[O:96][C@:97]([N:98]2:[C:99]([H:198]):[N:100]:[C:101]3:[C:102]([N:103]([H:199])[H:200]):[N:104]:[C:105]([H:201]):[N:106]:[C:107]:2:3)([H:202])[C@@:108]([O:109][H:203])([H:204])[C@@:110]1([O:111][P:112](=[O:113])([O:114][H:205])[O:115][H:206])[H:207])([H:208])[H:209])([H:210])[H:211])[H:212])[H:213])([H:214])[H:215])([H:216])[H:217])[H:218])([H:219])[H:220])([H:221])[H:222]
Source Database Data
Rxn Index | Original Reaction Text | Natural | Organism | Protein Refs | Protein DB | EC Number |
---|---|---|---|---|---|---|
113413 | erucoyl-CoA + 1,2-dioleoyl-sn-glycerol = CoA + 3-erucoyl-1,2-dioleoyl-sn-glycerol | False | Brassica napus | nan | 2.3.1.20 |
Derived Partial Reactions
EVODEX.1-P1669
[H]O[C@]1([H])[C@]([H])(OP(=O)(O[H])O[H])[C@@]([H])(C([H])([H])OP(=O)(O[H])OP(=O)(O[H])OC([H])([H])C(C([H])([H])[H])(C([H])([H])[H])[C@@]([H])(O[H])C(=O)N([H])C([H])([H])C([H])([H])C(=O)N([H])C([H])([H])C([H])([H])S[C:66]([C:65]([C:64]([C:63]([C:62]([C:61]([C:60]([C:59]([C:58]([C:57]([C:56]([C:55]([C:54](=[C:53]([C:52]([C:51]([C:50]([C:49]([C:48]([C:47]([C:46]([C:45]([H:261])([H:262])[H:263])([H:259])[H:260])([H:257])[H:258])([H:255])[H:256])([H:253])[H:254])([H:251])[H:252])([H:249])[H:250])([H:247])[H:248])[H:246])[H:245])([H:243])[H:244])([H:241])[H:242])([H:239])[H:240])([H:237])[H:238])([H:235])[H:236])([H:233])[H:234])([H:231])[H:232])([H:229])[H:230])([H:227])[H:228])([H:225])[H:226])([H:223])[H:224])=[O:67])O[C@@]1([H])N1:C([H]):N:C2:C(N([H])[H]):N:C([H]):N:C:2:1>>[H]C(=C([H])C([H])([H])C([H])([H])C([H])([H])C([H])([H])C([H])([H])C([H])([H])C([H])([H])C([H])([H])[H])C([H])([H])C([H])([H])C([H])([H])C([H])([H])C([H])([H])C([H])([H])C([H])([H])C(=O)OC([H])([H])[C@@]([H])(OC(=O)C([H])([H])C([H])([H])C([H])([H])C([H])([H])C([H])([H])C([H])([H])C([H])([H])C([H])=C([H])C([H])([H])C([H])([H])C([H])([H])C([H])([H])C([H])([H])C([H])([H])C([H])([H])C([H])([H])[H])C([H])([H])O[C:66]([C:65]([C:64]([C:63]([C:62]([C:61]([C:60]([C:59]([C:58]([C:57]([C:56]([C:55]([C:54](=[C:53]([C:52]([C:51]([C:50]([C:49]([C:48]([C:47]([C:46]([C:45]([H:261])([H:262])[H:263])([H:259])[H:260])([H:257])[H:258])([H:255])[H:256])([H:253])[H:254])([H:251])[H:252])([H:249])[H:250])([H:247])[H:248])[H:246])[H:245])([H:243])[H:244])([H:241])[H:242])([H:239])[H:240])([H:237])[H:238])([H:235])[H:236])([H:233])[H:234])([H:231])[H:232])([H:229])[H:230])([H:227])[H:228])([H:225])[H:226])([H:223])[H:224])=[O:67]