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llms.txt · MCP 가이드개인정보처리방침 · 이용약관 · 지원v1.8.0
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Water → 2-[9-[3,4-Dihydroxy-5-(methoxymethyl)oxolan-2-yl]-6-(2,2-diphenylethylamino)purin-2-yl]-1-(4-propan-2-ylpiperidin-1-yl)ethanone

HRID 176163
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인쇄 미리보기

반응식

HRID 176163 반응식
[CH2:74]([N:75]([CH:76]([CH3:77])[CH3:78])[CH:79]([CH3:80])[CH3:81])[CH3:82].[CH:1]([CH3:2])([CH3:3])[CH:4]1[CH2:5][CH2:6][NH:7][CH2:8][CH2:9]1.[CH:48]1([N:49]=[C:50]=[N:51][CH:52]2[CH2:53][CH2:54][CH2:55][CH2:56][CH2:57]2)[CH2:58][CH2:59][CH2:60][CH2:61][CH2:62]1.[Cl:83][CH2:84][Cl:85].[OH2:63].[OH:10][CH:11]1[CH:12]([n:20]2[c:21]3[n:22][c:23]([CH2:44][C:45](=[O:46])[OH:47])[n:24][c:25]([NH:29][CH2:30][CH:31]([c:32]4[cH:33][cH:34][cH:35][cH:36][cH:37]4)[c:38]4[cH:39][cH:40][cH:41][cH:42][cH:43]4)[c:26]3[n:27][cH:28]2)[O:13][CH:14]([CH2:17][O:18][CH3:19])[CH:15]1[OH:16].[n:64]1([OH:65])[c:66]2[cH:67][cH:68][cH:69][cH:70][c:71]2[n:72][n:73]1>>[CH:1]([CH3:2])([CH3:3])[CH:4]1[CH2:5][CH2:6][N:7]([C:45]([CH2:44][c:23]2[n:22][c:21]3[n:20]([CH:12]4[CH:11]([OH:10])[CH:15]([OH:16])[CH:14]([CH2:17][O:18][CH3:19])[O:13]4)[cH:28][n:27][c:26]3[c:25]([NH:29][CH2:30][CH:31]([c:32]3[cH:33][cH:34][cH:35][cH:36][cH:37]3)[c:38]3[cH:39][cH:40][cH:41][cH:42][cH:43]3)[n:24]2)=[O:46])[CH2:8][CH2:9]1
참가 물질출처 및 근거반응 노트

참가 물질

8

반응물 7

HCID 962WaterHCID 6344DichloromethaneHCID 10868DicyclohexylcarbodiimideHCID 757711-HydroxybenzotriazoleHCID 81531DiisopropylethylamineHCID 140569Piperidine, 4-(1-methylethyl)-HCID 183483872-[9-[3,4-Dihydroxy-5-(methoxymethyl)oxolan-2-yl]-6-(2,2-diphenylethylamino)purin-2-yl]acetic acid

생성물 1

HCID 183484592-[9-[3,4-Dihydroxy-5-(methoxymethyl)oxolan-2-yl]-6-(2,2-diphenylethylamino)purin-2-yl]-1-(4-propan-2-ylpiperidin-1-yl)ethanone

출처 및 근거

ORD 기록
ord-f263c630992941baa87042033d25a87d
출처 데이터셋
Training data from https://doi.org/10.1039/C8SC04228D (6/10)
DOI
10.1039/C8SC04228D

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