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Hydrochloric Acid → HCID 178435301, 화합물

HRID 1560592
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HRID 1560592 반응식
[C:48]([O:49][C:50]1([CH3:55])[CH2:51][CH2:52][CH2:53][CH2:54]1)([O:56][c:58]1[cH:59][cH:60][cH:61][cH:62][n:63]1)=[O:57].[CH2:73]1[O:74][CH2:75][CH2:76][CH2:77]1.[CH3:78][CH2:79][O:80][C:81]([CH3:82])=[O:83].[CH:64]([N:65]([CH2:66][CH3:67])[CH:68]([CH3:69])[CH3:70])([CH3:71])[CH3:72].[ClH:47].[NH2:1][CH:2]([C:3](=[O:4])[N:5]1[CH:6]([C:26](=[O:27])[NH:28][C:29]2([C:34]([NH:35][S:36](=[O:37])(=[O:38])[CH:39]3[CH2:40][CH2:41]3)=[O:42])[CH:30]([CH:32]=[CH2:33])[CH2:31]2)[CH2:7][C:8]([S:10][CH:11]([CH3:12])[CH3:13])([c:14]2[cH:15][cH:16][c:17](-[c:20]3[cH:21][cH:22][cH:23][cH:24][cH:25]3)[cH:18][cH:19]2)[CH2:9]1)[C:43]([CH3:44])([CH3:45])[CH3:46]>>[NH:1]([CH:2]([C:3](=[O:4])[N:5]1[CH:6]([C:26](=[O:27])[NH:28][C:29]2([C:34]([NH:35][S:36](=[O:37])(=[O:38])[CH:39]3[CH2:40][CH2:41]3)=[O:42])[CH:30]([CH:32]=[CH2:33])[CH2:31]2)[CH2:7][C:8]([S:10][CH:11]([CH3:12])[CH3:13])([c:14]2[cH:15][cH:16][c:17](-[c:20]3[cH:21][cH:22][cH:23][cH:24][cH:25]3)[cH:18][cH:19]2)[CH2:9]1)[C:43]([CH3:44])([CH3:45])[CH3:46])[C:48]([O:49][C:50]1([CH3:55])[CH2:51][CH2:52][CH2:53][CH2:54]1)=[O:56]
참가 물질출처 및 근거반응 노트

참가 물질

7

반응물 6

HCID 313Hydrochloric AcidHCID 8028TetrahydrofuranHCID 8857Ethyl AcetateHCID 81531DiisopropylethylamineHCID 67030375(1-Methylcyclopentyl) pyridin-2-yl carbonateHCID 178435300HCID 178435300, 화합물

생성물 1

HCID 178435301
HCID 178435301, 화합물

출처 및 근거

ORD 기록
ord-880edabc902548e7b7bbb61901d6e11b
출처 데이터셋
Training data from https://doi.org/10.1039/C8SC04228D (1/10)
DOI
10.1039/C8SC04228D

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