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CHEBI:74459 - (R)-3-hydroxypalmitoyl-CoA
| Formula | C37H66N7O18P3S |
| Net Charge | 0 |
| Average Mass | 1021.955 |
| Monoisotopic Mass | 1021.33979 |
| SMILES | CCCCCCCCCCCCC[C@@H](O)CC(=O)SCCNC(=O)CCNC(=O)[C@H](O)C(C)(C)COP(=O)(O)OP(=O)(O)OC[C@H]1O[C@@H](n2cnc3c(N)ncnc32)[C@H](O)[C@@H]1OP(=O)(O)O |
| InChI | InChI=1S/C37H66N7O18P3S/c1-4-5-6-7-8-9-10-11-12-13-14-15-25(45)20-28(47)66-19-18-39-27(46)16-17-40-35(50)32(49)37(2,3)22-59-65(56,57)62-64(54,55)58-21-26-31(61-63(51,52)53)30(48)36(60-26)44-24-43-29-33(38)41-23-42-34(29)44/h23-26,30-32,36,45,48-49H,4-22H2,1-3H3,(H,39,46)(H,40,50)(H,54,55)(H,56,57)(H2,38,41,42)(H2,51,52,53)/t25-,26-,30-,31-,32+,36-/m1/s1 |
| InChIKey | DEHLMTDDPWDRDR-ODUGITAYSA-N |
| Roles Classification |
|---|
| Chemical Role: | acyl donor Any donor that can transfer acyl groups between molecular entities. |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| (R)-3-hydroxypalmitoyl-CoA (CHEBI:74459) has functional parent (R)-3-hydroxypalmitic acid (CHEBI:38247) |
| (R)-3-hydroxypalmitoyl-CoA (CHEBI:74459) is a (R)-3-hydroxyacyl-CoA (CHEBI:15456) |
| (R)-3-hydroxypalmitoyl-CoA (CHEBI:74459) is a 11,12-saturated fatty acyl-CoA (CHEBI:85348) |
| (R)-3-hydroxypalmitoyl-CoA (CHEBI:74459) is a 3-hydroxy fatty acyl-CoA (CHEBI:20060) |
| (R)-3-hydroxypalmitoyl-CoA (CHEBI:74459) is a long-chain fatty acyl-CoA (CHEBI:33184) |
| (R)-3-hydroxypalmitoyl-CoA (CHEBI:74459) is conjugate acid of (R)-3-hydroxypalmitoyl-CoA(4−) (CHEBI:74278) |
| Incoming Relation(s) |
| (R)-3-hydroxypalmitoyl-CoA(4−) (CHEBI:74278) is conjugate base of (R)-3-hydroxypalmitoyl-CoA (CHEBI:74459) |
| IUPAC Name |
|---|
| 3'-phosphoadenosine 5'-{3-[(3R)-3-hydroxy-4-({3-[(2-{[(3R)-3-hydroxyhexadecanoyl]sulfanyl}ethyl)amino]-3-oxopropyl}amino)-2,2-dimethyl-4-oxobutyl] dihydrogen diphosphate} |
| Synonyms | Source |
|---|---|
| (R)-3-hydroxyhexadecanoyl-CoA | ChEBI |
| (R)-3-hydroxyhexadecanoyl-coenzyme A | ChEBI |
| (R)-3-hydroxypalmitoyl-coenzyme A | ChEBI |
| Manual Xrefs | Databases |
|---|---|
| CPD-14920 | MetaCyc |