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Huagongshe화공사 화학 정보 인쇄 보고서 · 연구 참고용
HRID 1019492생성일: 2026년 10월 27일

1,3-Butadiene → (3R,5R,9R)-1-[(2R,3S,4R,5R)-5-(6-amino-9H-purin-9-yl)-4-hydroxy-3-(phosphonooxy)tetrahydrofuran-2-yl]-3,5,9-trihydroxy-8,8-dimethyl-10,14,19,21-tetraoxo-2,4,6-trioxa-18-thia-11,15-diaza-3,5-diphosphatricosan-23-oic acid 3,5-dioxide (non-preferred name)

https://huagongshe.com/reaction/1019492

반응식

참여 물질

역할이름HCID투입량
반응물1,3-ButadieneHCID 7845—
반응물3-Buten-1-olHCID 69389—
반응물acetyl CoAHCID 444493—
반응물Malonyl CoAHCID 644066—
반응물Penta-2,4-dienoateHCID 73155734—
생성물(3R,5R,9R)-1-[(2R,3S,4R,5R)-5-(6-amino-9H-purin-9-yl)-4-hydroxy-3-(phosphonooxy)tetrahydrofuran-2-yl]-3,5,9-trihydroxy-8,8-dimethyl-10,14,19,21-tetraoxo-2,4,6-trioxa-18-thia-11,15-diaza-3,5-diphosphatricosan-23-oic acid 3,5-dioxide (non-preferred name)HCID 86661434—

반응 단계

Pathways to 3-butene-1-ol, butadiene and 2,4-pentadienoate from malonyl-CoA and acetyl-CoA are shown in FIG. 21. In these pathways, malonyl-CoA and acetyl-CoA are joined by a thiolase to form 3-oxoglutaryl-CoA. This intermediate can then be converted to 3,5-dihydroxypentanoate by several alternate routes (Steps B/C/D, Steps B/G, Steps H/I/J, Steps H/L/D, K/J). Once formed, 3,5-dihydroxypentanoate can be decarboxylated by a 3-hydroxyacid decarboxylase to form 3-butene-1-ol (Step M). Subsequent dehydration by a 3-butene-1-ol dehydrogenase or a chemical catalyst yields butadiene (Step O). Alternately, 3,5-dihydroxypentanoate can be dehydrated to 5-hydroxypent-2-enoate as shown in Step E. This intermediate can then be decarboxylated to 3-butene-1-ol (Step N) or further dehydrated to 2,4-pentadienoate (Step F).

출처 및 근거

DOI10.6084/m9.figshare.5104873.v1
특허 번호US08715957B2
출처 데이터셋uspto-grants-2014_05
ORD IDord-6c55b5697992423b96a698721edb17eb
출처 메모uspto-grants-2014_05