Hydrochloric Acid → Hydrochloric Acid

HRID 286906노트

반응식

HRID 286906 반응식
[C:1]([CH3:2])([CH3:3])([CH3:4])[O:5][C:6](=[O:7])[CH2:8][N:9]1[C:10](=[O:28])[CH:11]([NH:20][CH:21]([CH3:22])[C:23](=[O:24])[O:25][CH2:26][CH3:27])[CH2:12][S:13][c:14]2[c:15]1[cH:16][cH:17][cH:18][cH:19]2.[ClH:29].[O:30]1[CH2:31][CH2:32][O:33][CH2:34][CH2:35]1>>[ClH:29].[O:5]=[C:6]([OH:7])[CH2:8][N:9]1[C:10](=[O:28])[CH:11]([NH:20][CH:21]([CH3:22])[C:23](=[O:24])[O:25][CH2:26][CH3:27])[CH2:12][S:13][c:14]2[c:15]1[cH:16][cH:17][cH:18][cH:19]2

참가 물질

5

반응물 3

HCID 313Hydrochloric AcidHCID 312751,4-DioxaneHCID 134707795-t-butoxycarbonylmethyl-3-(1-ethoxycarbonylethylamino)-2,3-dihydro-1,5-benzothiazepin-4(5H)-one

생성물 2

HCID 313Hydrochloric AcidHCID 134545772-[3-[(1-Ethoxy-1-oxopropan-2-yl)amino]-4-oxo-2,3-dihydro-1,5-benzothiazepin-5-yl]acetic acid

출처 및 근거

ORD 기록
ord-33be74dc2f3649dea5beebb25022a128
출처 데이터셋
Training data from https://doi.org/10.1039/C8SC04228D (8/10)

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