| Compound-ID | 9414 |
| Common Name | 4-Hydroxy-3-methoxyphenyl-beta-hydroxypropionyl-CoA |
| Synonyms |
3-Hydroxy-3-(4-hydroxy-3-methoxyphenyl)propionyl-CoA
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| InChI |
InChI=1S/C31H46N7O20P3S/c1-31(2,26(44)29(45)34-7-6-21(41)33-8-9-62-22(42)11-18(40)16-4-5-17(39)19(10-16)53-3)13-55-61(51,52)58-60(49,50)54-12-20-25(57-59(46,47)48)24(43)30(56-20)38-15-37-23-27(32)35-14-36-28(23)38/h4-5,10,14-15,18,20,24-26,30,39-40,43-44H,6-9,11-13H2,1-3H3,(H,33,41)(H,34,45)(H,49,50)(H,51,52)(H2,32,35,36)(H2,46,47,48)/t18?,20-,24-,25-,26+,30-/m1/s1
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| SMILES |
COc1cc(ccc1(O))C(O)CC(=O)SCCNC(=O)CCNC(=O)C(O)C(C)(C)COP(O)(=O)OP(O)(=O)OCC2OC(C(O)C2(OP(O)(O)=O))n4cnc3c(N)ncnc34
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| External Links | |
| KEGG-COMPOUND-ID |
C07303
|
| PUBCHEM-ID | 9511 |
| ChEBI-ID |
17068
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View all entries for compound: 4-Hydroxy-3-methoxyphenyl-beta-hydroxypropionyl-CoA |