홈MCP워크벤치Skills
홈워크벤치알림마이페이지
llms.txt · MCP 가이드개인정보처리방침 · 이용약관 · 지원v1.8.0
  1. 홈
  2. /반응

Water → 3-Benzyl-7-(4-tert-butoxycarbonyl-piperazin-1-yl)-2-methylsulfanyl-indole-1-carboxylic acid tert-butyl ester

HRID 314457
노트
인쇄 미리보기

반응식

HRID 314457 반응식
[C:1]([CH3:2])([CH3:3])([CH3:4])[O:5][C:6](=[O:7])[n:8]1[cH:9][c:10]([CH2:30][c:31]2[cH:32][cH:33][cH:34][cH:35][cH:36]2)[c:11]2[cH:12][cH:13][cH:14][c:15]([N:17]3[CH2:18][CH2:19][N:20]([C:23](=[O:24])[O:25][C:26]([CH3:27])([CH3:28])[CH3:29])[CH2:21][CH2:22]3)[c:16]12.[CH2:46]1[O:47][CH2:48][CH2:49][CH2:50]1.[CH3:42][S:43][CH3:44].[CH:37]([Li:38])([CH2:39][CH3:40])[CH3:41].[OH2:45]>>[C:1]([CH3:2])([CH3:3])([CH3:4])[O:5][C:6](=[O:7])[n:8]1[c:9]([S:43][CH3:42])[c:10]([CH2:30][c:31]2[cH:32][cH:33][cH:34][cH:35][cH:36]2)[c:11]2[cH:12][cH:13][cH:14][c:15]([N:17]3[CH2:18][CH2:19][N:20]([C:23](=[O:24])[O:25][C:26]([CH3:27])([CH3:28])[CH3:29])[CH2:21][CH2:22]3)[c:16]12
참가 물질출처 및 근거반응 노트

참가 물질

6

반응물 5

HCID 962WaterHCID 1068Dimethyl SulfideHCID 8028TetrahydrofuranHCID 685857503-Benzyl-7-(4-tert-butoxycarbonyl-piperazin-1-yl)-indole-1-carboxylic acid tert-butyl esterHCID 178418400CID 53628100

생성물 1

HCID 685880193-Benzyl-7-(4-tert-butoxycarbonyl-piperazin-1-yl)-2-methylsulfanyl-indole-1-carboxylic acid tert-butyl ester

출처 및 근거

ORD 기록
ord-806b45fc9bfe485dbd5ba9229e9ac879
출처 데이터셋
Training data from https://doi.org/10.1039/C8SC04228D (8/10)
DOI
10.1039/C8SC04228D

반응 노트

불러오는 중…

이 페이지에서참가 물질출처 및 근거반응 노트