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Hydrochloric Acid → {2-[3-(tert-Butoxycarbonyl-phenethyl-amino)-propylsulfanyl]-benzoimidazol-1-yl}-acetic acid

HRID 2312507
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HRID 2312507 반응식
[C:1]([CH3:2])([CH3:3])([CH3:4])[O:5][C:6](=[O:7])[N:8]([CH2:9][CH2:10][CH2:11][S:12][c:13]1[n:14][c:15]2[c:16]([n:17]1[CH2:18][C:19](=[O:20])[O:21][C:22]([CH3:23])([CH3:24])[CH3:25])[cH:26][cH:27][cH:28][cH:29]2)[CH2:30][CH2:31][c:32]1[cH:33][cH:34][cH:35][cH:36][cH:37]1.[CH2:40]1[O:41][CH2:42][CH2:43][CH2:44]1.[Cl:46][CH2:47][Cl:48].[ClH:45].[Na+:39].[OH-:38].[OH2:49]>>[C:1]([CH3:2])([CH3:3])([CH3:4])[O:5][C:6](=[O:7])[N:8]([CH2:9][CH2:10][CH2:11][S:12][c:13]1[n:14][c:15]2[c:16]([n:17]1[CH2:18][C:19](=[O:20])[OH:21])[cH:26][cH:27][cH:28][cH:29]2)[CH2:30][CH2:31][c:32]1[cH:33][cH:34][cH:35][cH:36][cH:37]1
참가 물질출처 및 근거반응 노트

참가 물질

8

반응물 7

HCID 313Hydrochloric AcidHCID 923Sodium IonHCID 961HydroxideHCID 962WaterHCID 6344DichloromethaneHCID 8028TetrahydrofuranHCID 86620029tert-Butyl {2-[3-(tert-butoxycarbonyl-phenethyl-amino)-propylsulfanyl]-benzoimidazol-1-yl}-acetate

생성물 1

HCID 69313744{2-[3-(tert-Butoxycarbonyl-phenethyl-amino)-propylsulfanyl]-benzoimidazol-1-yl}-acetic acid

출처 및 근거

ORD 기록
ord-ae2564968c8b4402b2d58677fc081d50
출처 데이터셋
Training data from https://doi.org/10.1039/C8SC04228D (10/10)
DOI
10.1039/C8SC04228D

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