acetoacetyl-CoA → HCID 442450, 화합물

HRID 2282340

반응식

HRID 2282340 반응식
[C:1]([S:11][CH2:12][CH2:13][NH:14][C:15](=[O:58])[CH2:16][CH2:17][NH:18][C:19](=[O:57])[C@H:20]([OH:56])[C:21]([CH3:55])([CH3:54])[CH2:22][O:23][P:24]([OH:53])(=[O:52])[O:25][P:26]([OH:51])(=[O:50])[O:27][CH2:28][C@H:29]1[O:33][C@@H:32]([N:34]2[C:43]3[N:42]=[CH:41][N:40]=[C:38]([NH2:39])[C:37]=3[N:36]=[CH:35]2)[C@H:31]([OH:44])[C@@H:30]1[O:45][P:46]([OH:49])([OH:48])=[O:47])(=[O:10])[CH2:2][CH2:3][CH2:4][CH2:5][CH2:6][C:7]([OH:9])=O.OC(CCCC(O)=O)CC(SCCNC(=O)CCNC(=O)[C@H](O)C(C)(C)COP(O)(=O)OP(O)(=O)OC[C@H]1O[C@@H](N2C3N=CN=C(N)C=3N=C2)[C@H](O)[C@@H]1OP(O)(O)=O)=O.C(SCCNC(=O)CCNC(=O)[C@H](O)C(C)(C)COP(O)(=O)OP(O)(=O)OC[C@H]1O[C@@H](N2C3N=CN=C(N)C=3N=C2)[C@H](O)[C@@H]1OP(O)(O)=O)(=O)CC(C)=O>>[CH3:55][C:21]([CH:20]([OH:56])[C:19]([NH:18][CH2:17][CH2:16][C:15]([NH:14][CH2:13][CH2:12][S:11][C:1]([C:2]1[C:7](=[O:9])[CH2:6][CH2:5][CH2:4][CH:3]=1)=[O:10])=[O:58])=[O:57])([CH2:22][O:23][P:24]([O:25][P:26]([O:27][CH2:28][C@H:29]1[O:33][C@@H:32]([N:34]2[C:43]3[N:42]=[CH:41][N:40]=[C:38]([NH2:39])[C:37]=3[N:36]=[CH:35]2)[C@H:31]([OH:44])[C@@H:30]1[O:45][P:46]([OH:48])([OH:49])=[O:47])([OH:51])=[O:50])([OH:53])=[O:52])[CH3:54]

참가 물질

4

반응물 3

HCID 92153acetoacetyl-CoAHCID 3082140Coenzyme A, S-(hydrogen heptanedioate)HCID 95430223-Hydroxypimeloyl-CoA2회

생성물 1

HCID 442450HCID 442450, 화합물

실험 절차

Alternative routes for producing a cyclic compound from 3-hydroxypimeloyl-CoA that do not proceed through pimeloyl-CoA are shown in FIG. 3. This route is found in Geobacter metallireducens and Thauera aromatica, among others, in the direction of beta-oxidation. In the route, the biosynthesis of 3-hydroxypimelyl-CoA proceeds from acetoacetyl-CoA, as described above. 3-Hydroxypimeloyl-CoA is dehydrated to form a cyclic product, 6-oxocylohex-1-ene-1-carboxyl-CoA (6-KCH-CoA). 6-KCH-CoA is then converted to cyclohexanone in three enzymatic steps: removal of the CoA moiety, decarboxylation and reduction. With a reversible PEP carboxykinase, this pathway is predicted to achieve a theoretical yield of cyclohexanone (0.75 mol/mol) and is able to achieve an ATP yield of 0.56 mol/mol if a transferase or ATP synthase is utilized in step 2.

출처 및 근거

ORD 기록
ord-c8fbaa3cc5a84e3a8be99d44e257e953
출처 데이터셋
uspto-grants-2015_09
특허 번호
US09139853B2

연결된 노트

불러오는 중…