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

Acetic Acid → HCID 59398044, 화합물

HRID 171873
노트
인쇄 미리보기

반응식

HRID 171873 반응식
[C:42]([O:43][BH-:44]([O:45][C:46](=[O:47])[CH3:48])[O:49][C:50](=[O:51])[CH3:52])(=[O:53])[CH3:54].[C:56](=[O:57])([O-:58])[OH:59].[CH3:1][O:2][c:3]1[c:4]2[cH:5][cH:6][c:7](=[O:16])[n:8]([CH2:13][CH:14]=[O:15])[c:9]2[cH:10][cH:11][cH:12]1.[CH3:65][C:66](=[O:67])[OH:68].[CH:61]([Cl:62])([Cl:63])[Cl:64].[Cl:69][CH2:70][Cl:71].[Na+:55].[Na+:60].[O:17]1[CH2:18][CH2:19][O:20][c:21]2[c:22]1[cH:23][cH:24][c:25]([CH2:27][N:28]([C:29]([O:30][C:31]([CH3:32])([CH3:33])[CH3:34])=[O:35])[CH:36]1[CH2:37][CH2:38][NH:39][CH2:40][CH2:41]1)[cH:26]2>>[CH3:1][O:2][c:3]1[c:4]2[cH:5][cH:6][c:7](=[O:16])[n:8]([CH2:13][CH2:14][N:39]3[CH2:38][CH2:37][CH:36]([N:28]([CH2:27][c:25]4[cH:24][cH:23][c:22]5[c:21]([cH:26]4)[O:20][CH2:19][CH2:18][O:17]5)[C:29]([O:30][C:31]([CH3:32])([CH3:33])[CH3:34])=[O:35])[CH2:41][CH2:40]3)[c:9]2[cH:10][cH:11][cH:12]1
참가 물질출처 및 근거반응 노트

참가 물질

9

반응물 8

HCID 176Acetic AcidHCID 769Bicarbonate IonHCID 923Sodium Ion2회HCID 6212ChloroformHCID 6344DichloromethaneHCID 2724942TriacetoxyborohydrideHCID 57815320Tert-butyl (2,3-dihydro-1,4-benzodioxin-6-ylmethyl)(piperidin-4-yl)carbamate
HCID 59398328
HCID 59398328, 화합물

생성물 1

HCID 59398044HCID 59398044, 화합물

출처 및 근거

ORD 기록
ord-343388d6a5c84622bc30747cf78a86af
출처 데이터셋
Training data from https://doi.org/10.1039/C8SC04228D (9/10)
DOI
10.1039/C8SC04228D

반응 노트

불러오는 중…

이 페이지에서참가 물질출처 및 근거반응 노트