| Compound-ID | 26174 |
| Common Name | (+)-S-Ibuprofenoyl-CoA |
| InChI |
InChI=1S/C34H52N7O17P3S/c1-19(2)14-21-6-8-22(9-7-21)20(3)33(46)62-13-12-36-24(42)10-11-37-31(45)28(44)34(4,5)16-55-61(52,53)58-60(50,51)54-15-23-27(57-59(47,48)49)26(43)32(56-23)41-18-40-25-29(35)38-17-39-30(25)41/h6-9,17-20,23,26-28,32,43-44H,10-16H2,1-5H3,(H,36,42)(H,37,45)(H,50,51)(H,52,53)(H2,35,38,39)(H2,47,48,49)/t20-,23+,26+,27+,28?,32+/m0/s1
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| SMILES |
C[C@@H](C1=CC=C(C=C1)CC(C)C)C(=O)SCCNC(=O)CCNC(=O)C(C(C)(C)COP(=O)(O)OP(=O)(O)OC[C@@H]2[C@H]([C@H]([C@@H](O2)N3C=NC4=C3N=CN=C4N)O)OP(=O)(O)O)O
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| External Links | |
| PUBCHEM-CID | 102171028 |
| ChEBI-ID |
146204
|
| METACYC-ID | CPD-19079 |
| METANETX-ID | MNXM165244 |
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View all entries for compound: (+)-S-Ibuprofenoyl-CoA |