Compound Details

 Compound-ID 6567
 Common Name 2-Methylbut-2-enoyl-CoA
 Synonyms (E)-2-Methylcrotonoyl-CoA
Methylcrotonoyl-CoA
Methylcrotonyl-CoA
Tigloyl-CoA
Tiglyl-CoA
trans-2-Methylbut-2-enoyl-CoA
2-Methylcrotanoyl-CoA
 InChI InChI=1S/C26H42N7O17P3S/c1-5-14(2)25(38)54-9-8-28-16(34)6-7-29-23(37)20(36)26(3,4)11-47-53(44,45)50-52(42,43)46-10-15-19(49-51(39,40)41)18(35)24(48-15)33-13-32-17-21(27)30-12-31-22(17)33/h5,12-13,15,18-20,24,35-36H,6-11H2,1-4H3,(H,28,34)(H,29,37)(H,42,43)(H,44,45)(H2,27,30,31)(H2,39,40,41)/t15-,18-,19-,20+,24-/m1/s1
 SMILES CC=C(C)C(=O)SCCNC(=O)CCNC(=O)C(O)C(C)(C)COP(O)(=O)OP(O)(=O)OCC1OC(C(O)C1(OP(O)(O)=O))n3cnc2c(N)ncnc23
 External Links
 KEGG-COMPOUND-ID C03345
 PUBCHEM-ID 6188
 ChEBI-ID 11614
15478
57337
57260
19697
19691
1204
1199
11619
10949
 REACTOME-ID 70799
 METACYC-ID CPD-1083
 METANETX-ID MNXM738795
 BioModels 11614
15478


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