| Compound-ID | 20759 |
| Common Name | Indoleacryloyl-CoA |
| Synonyms |
S-[3-(1H-Indole-3-yl)acryloyl]coenzyme A
|
| InChI |
InChI=1S/C32H43N8O17P3S/c1-32(2,27(44)30(45)35-10-9-22(41)34-11-12-61-23(42)8-7-18-13-36-20-6-4-3-5-19(18)20)15-54-60(51,52)57-59(49,50)53-14-21-26(56-58(46,47)48)25(43)31(55-21)40-17-39-24-28(33)37-16-38-29(24)40/h3-8,13,16-17,21,25-27,31,36,43-44H,9-12,14-15H2,1-2H3,(H,34,41)(H,35,45)(H,49,50)(H,51,52)(H2,33,37,38)(H2,46,47,48)/b8-7+/t21-,25-,26-,27+,31-/m1/s1
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| SMILES |
CC(C)(COP(=O)(O)OP(=O)(O)OC[C@@H]1[C@H]([C@H]([C@@H](O1)N2C=NC3=C2N=CN=C3N)O)OP(=O)(O)O)[C@H](C(=O)NCCC(=O)NCCSC(=O)/C=C/C4=CNC5=CC=CC=C54)O
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| External Links | |
| KEGG-COMPOUND-ID |
C22207
|
| PUBCHEM-CID | 6449959 |
| ChEBI-ID |
143009
|
| CHEMSPIDER-ID | 4952620 |
| METACYC-ID | CPD-21497 |
| METANETX-ID | MNXM164845 |
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View all entries for compound: Indoleacryloyl-CoA |