产品名称：
hydrocaffeoyl-CoA
其他名称： hydrocaffeoyl-CoA；dihydrocaffeoyl-CoA(4-)；hydrocaffeoyl-CoA(4-)；hydrocaffeoyl-coenzyme A(4-)；dihydrocaffeoyl-coenzyme A(4-)；CHEBI:87137；3-(3,4-dihydroxyphenyl)propanoyl-CoA(4-)；3-(3,4-dihydroxyphenyl)propanoyl-coenzyme A(4-)；Q27159394
其他名称： hydrocaffeoyl-CoA；dihydrocaffeoyl-CoA(4-)；hydrocaffeoyl-CoA(4-)；hydrocaffeoyl-coenzyme A(4-)；dihydrocaffeoyl-coenzyme A(4-)；CHEBI:87137；3-(3,4-dihydroxyphenyl)propanoyl-CoA(4-)；3-(3,4-dihydroxyphenyl)propanoyl-coenzyme A(4-)；Q27159394
结构信息
| 分子式 | C30H40N7O19P3S-4 | 分子量 | 927.7 | ||
| IUPAC Name | [(2R,3S,4R,5R)-5-(6-aminopurin-9-yl)-2-[[[[(3R)-4-[[3-[2-[3-(3,4-dihydroxyphenyl)propanoylsulfanyl]ethylamino]-3-oxopropyl]amino]-3-hydroxy-2,2-dimethyl-4-oxobutoxy]-oxidophosphoryl]oxy-oxidophosphoryl]oxymethyl]-4-hydroxyoxolan-3-yl] phosphate | ||||
| InChIKey | NDSCGRAEWDSLKF-FUEUKBNZSA-J | ||||
| InChI | InChI=1S/C30H44N7O19P3S/c1-30(2,25(43)28(44)33-8-7-20(40)32-9-10-60-21(41)6-4-16-3-5-17(38)18(39)11-16)13-53-59(50,51)56-58(48,49)52-12-19-24(55-57(45,46)47)23(42)29(54-19)37-15-36-22-26(31)34-14-35-27(22)37/h3,5,11,14-15,19,23-25,29,38-39,42-43H,4,6-10,12-13H2,1-2H3,(H,32,40)(H,33,44)(H,48,49)(H,50,51)(H2,31,34,35)(H2,45,46,47)/p-4/t19-,23-,24-,25+,29-/m1/s1 | ||||
| SMILES | CC(C)(COP(=O)([O-])OP(=O)([O-])OCC1C(C(C(O1)N2C=NC3=C(N=CN=C32)N)O)OP(=O)([O-])[O-])C(C(=O)NCCC(=O)NCCSC(=O)CCC4=CC(=C(C=C4)O)O)O | ||||
