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Acetonitrile → [3,4-Diacetyloxy-5-[2-cyano-6-(naphthalen-1-ylmethylamino)purin-9-yl]oxolan-2-yl]methyl acetate

HRID 2141044
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HRID 2141044 반응식
[C:1]([CH3:2])(=[O:3])[O:4][CH:5]1[CH:6]([CH2:26][O:27][C:28]([CH3:29])=[O:30])[O:7][CH:8]([n:14]2[c:15]3[n:16][c:17]([C:24]#[N:25])[n:18][c:19]([Cl:23])[c:20]3[n:21][cH:22]2)[CH:9]1[O:10][C:11]([CH3:12])=[O:13].[CH3:43][CH2:44][N:45]([CH2:46][CH3:47])[CH2:48][CH3:49].[CH3:50][C:51]#[N:52].[c:31]1([CH2:41][NH2:42])[cH:32][cH:33][cH:34][c:35]2[cH:36][cH:37][cH:38][cH:39][c:40]12>>[C:1]([CH3:2])(=[O:3])[O:4][CH:5]1[CH:6]([CH2:26][O:27][C:28]([CH3:29])=[O:30])[O:7][CH:8]([n:14]2[c:15]3[n:16][c:17]([C:24]#[N:25])[n:18][c:19]([NH:42][CH2:41][c:31]4[cH:32][cH:33][cH:34][c:35]5[cH:36][cH:37][cH:38][cH:39][c:40]45)[c:20]3[n:21][cH:22]2)[CH:9]1[O:10][C:11]([CH3:12])=[O:13]
참가 물질출처 및 근거반응 노트

참가 물질

5

반응물 4

HCID 6342AcetonitrileHCID 83551-NaphthalenemethanamineHCID 8471TriethylamineHCID 22346182[3,4-Diacetyloxy-5-(6-chloro-2-cyanopurin-9-yl)oxolan-2-yl]methyl acetate

생성물 1

HCID 18317214[3,4-Diacetyloxy-5-[2-cyano-6-(naphthalen-1-ylmethylamino)purin-9-yl]oxolan-2-yl]methyl acetate

출처 및 근거

ORD 기록
ord-5e07718b10684136b56945eaf2166655
출처 데이터셋
Training data from https://doi.org/10.1039/C8SC04228D (4/10)
DOI
10.1039/C8SC04228D

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