| Compound-ID | 2744 |
| Common Name | 3-Oxooctanoyl-CoA |
| Synonyms |
3-Ketooctanoyl-CoA
|
| InChI |
InChI=1S/C29H48N7O18P3S/c1-4-5-6-7-17(37)12-20(39)58-11-10-31-19(38)8-9-32-27(42)24(41)29(2,3)14-51-57(48,49)54-56(46,47)50-13-18-23(53-55(43,44)45)22(40)28(52-18)36-16-35-21-25(30)33-15-34-26(21)36/h15-16,18,22-24,28,40-41H,4-14H2,1-3H3,(H,31,38)(H,32,42)(H,46,47)(H,48,49)(H2,30,33,34)(H2,43,44,45)/t18-,22-,23-,24+,28-/m1/s1
|
| SMILES |
CCCCCC(=O)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 |
C05267
|
| PUBCHEM-ID | 7654 |
| ChEBI-ID |
28264
62619 20175 1645 |
| REACTOME-ID | 77328 |
| METACYC-ID | CPD0-2106 |
| METANETX-ID | MNXM706 |
| BioModels |
28264 |
|
View all entries for compound: 3-Oxooctanoyl-CoA |