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Hydrochloric Acid → 13-cyclohexyl-10-((cyclopropylsulfonyl)carbamoyl)-3-methoxy-7H-indolo[2,1-a][2]benzazepine-6-carboxylic acid

HRID 1572056
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HRID 1572056 반응식
[CH2:43]1[O:44][CH2:45][CH2:46][CH2:47]1.[CH:1]1([c:7]2[c:8]3[cH:9][cH:10][c:11]([C:31]([NH:32][S:33](=[O:34])(=[O:35])[CH:36]4[CH2:37][CH2:38]4)=[O:39])[cH:12][c:13]3[n:14]3[c:15]2-[c:16]2[c:17]([cH:25][c:26]([O:29][CH3:30])[cH:27][cH:28]2)[CH:18]=[C:19]([C:21](=[O:22])[O:23][CH3:24])[CH2:20]3)[CH2:2][CH2:3][CH2:4][CH2:5][CH2:6]1.[ClH:42].[Na+:41].[OH-:40]>>[CH:1]1([c:7]2[c:8]3[cH:9][cH:10][c:11]([C:31]([NH:32][S:33](=[O:34])(=[O:35])[CH:36]4[CH2:37][CH2:38]4)=[O:39])[cH:12][c:13]3[n:14]3[c:15]2-[c:16]2[c:17]([cH:25][c:26]([O:29][CH3:30])[cH:27][cH:28]2)[CH:18]=[C:19]([C:21](=[O:22])[OH:23])[CH2:20]3)[CH2:2][CH2:3][CH2:4][CH2:5][CH2:6]1
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참가 물질

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반응물 5

HCID 313Hydrochloric AcidHCID 923Sodium IonHCID 961HydroxideHCID 8028TetrahydrofuranHCID 57559080methyl 13-cyclohexyl-10-((cyclopropylsulfonyl)carbamoyl)-3-methoxy-7H-indolo [2,1-a][2]benzazepine-6-carboxylate

생성물 1

HCID 57559096
13-cyclohexyl-10-((cyclopropylsulfonyl)carbamoyl)-3-methoxy-7H-indolo[2,1-a][2]benzazepine-6-carboxylic acid

출처 및 근거

ORD 기록
ord-88ab297a1fb840c5b4d7e2437db5db62
출처 데이터셋
Training data from https://doi.org/10.1039/C8SC04228D (1/10)
DOI
10.1039/C8SC04228D

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