Compound-ID | 2599 |
Common Name | 3-Methylbutanoyl-CoA |
Synonyms |
Isovaleryl-CoA
Isopentanoyl-CoA |
InChI |
InChI=1S/C26H44N7O17P3S/c1-14(2)9-17(35)54-8-7-28-16(34)5-6-29-24(38)21(37)26(3,4)11-47-53(44,45)50-52(42,43)46-10-15-20(49-51(39,40)41)19(36)25(48-15)33-13-32-18-22(27)30-12-31-23(18)33/h12-15,19-21,25,36-37H,5-11H2,1-4H3,(H,28,34)(H,29,38)(H,42,43)(H,44,45)(H2,27,30,31)(H2,39,40,41)/t15-,19-,20-,21+,25-/m1/s1
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SMILES |
CC(C)CC(=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 |
C02939
|
PUBCHEM-ID | 5858 |
ChEBI-ID |
15487
57345 20126 1598 14481 11856 |
REACTOME-ID | 70715 |
METACYC-ID | ISOVALERYL-COA |
METANETX-ID | MNXM736744 |
BioModels |
15487 |
View all entries for compound: 3-Methylbutanoyl-CoA |