| Compound-ID | 2341 |
| Common Name | Octanoyl-CoA |
| InChI |
InChI=1S/C29H50N7O17P3S/c1-4-5-6-7-8-9-20(38)57-13-12-31-19(37)10-11-32-27(41)24(40)29(2,3)15-50-56(47,48)53-55(45,46)49-14-18-23(52-54(42,43)44)22(39)28(51-18)36-17-35-21-25(30)33-16-34-26(21)36/h16-18,22-24,28,39-40H,4-15H2,1-3H3,(H,31,37)(H,32,41)(H,45,46)(H,47,48)(H2,30,33,34)(H2,42,43,44)/t18-,22-,23-,24+,28-/m1/s1
|
| SMILES |
CCCCCCCC(=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 |
C01944
|
| PUBCHEM-ID | 5048 |
| ChEBI-ID |
15533
7724 57386 41542 25651 14681 |
| REACTOME-ID | 77337 |
| METACYC-ID | CPD-196 |
| METANETX-ID | MNXM734507 |
| BioModels |
15533 |
|
View all entries for compound: Octanoyl-CoA |