Cyclohexylamine → [4-Benzoyloxy-5-[6-(cyclohexylamino)-2-iodopurin-9-yl]-2-(ethylcarbamoyl)oxolan-3-yl] benzoate

HRID 1206890

반응식

HRID 1206890 반응식
[C:1]([c:2]1[cH:3][cH:4][cH:5][cH:6][cH:7]1)(=[O:8])[O:9][CH:10]1[CH:11]([n:29]2[c:30]3[n:31][c:32]([I:39])[n:33][c:34]([Cl:38])[c:35]3[n:36][cH:37]2)[O:12][CH:13]([C:24](=[O:25])[NH:26][CH2:27][CH3:28])[CH:14]1[O:15][C:16]([c:17]1[cH:18][cH:19][cH:20][cH:21][cH:22]1)=[O:23].[NH2:40][CH:41]1[CH2:42][CH2:43][CH2:44][CH2:45][CH2:46]1>>[C:1]([c:2]1[cH:3][cH:4][cH:5][cH:6][cH:7]1)(=[O:8])[O:9][CH:10]1[CH:11]([n:29]2[c:30]3[n:31][c:32]([I:39])[n:33][c:34]([NH:40][CH:41]4[CH2:42][CH2:43][CH2:44][CH2:45][CH2:46]4)[c:35]3[n:36][cH:37]2)[O:12][CH:13]([C:24](=[O:25])[NH:26][CH2:27][CH3:28])[CH:14]1[O:15][C:16]([c:17]1[cH:18][cH:19][cH:20][cH:21][cH:22]1)=[O:23]

참가 물질

3

반응물 2

HCID 7965CyclohexylamineHCID 229724694-(Benzoyloxy)-2-(6-chloro-2-iodo-9H-purin-9-yl)-5-[(ethylamino)carbonyl]-tetrahydro-3-furanyl benzoate

생성물 1

HCID 22972470[4-Benzoyloxy-5-[6-(cyclohexylamino)-2-iodopurin-9-yl]-2-(ethylcarbamoyl)oxolan-3-yl] benzoate

출처 및 근거

ORD 기록
ord-77125e2293104ed4b2130b90f8149dde
출처 데이터셋
Training data from https://doi.org/10.1039/C8SC04228D (5/10)

연결된 노트

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