HRID2258391

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID6227

Bromoacetic acid

C2H3BrO2

结构：CCC(Cc1c(I)cc(I)c(NC(=O)CCCCCNC(=O)CNCCNCCN)c1I)C(=O)O

HCID22921396

未命名化合物

PRODUCTS

生成物

结构：CCC(Cc1c(I)cc(I)c(NC(=O)CCCCCNC(=O)CN(CCN(CCN(CC(=O)O)CC(=O)O)CC(=O)O)CC(=O)O)c1I)C(=O)O

HCID10419126

未命名化合物

收率 41.3%

AUXILIARIES

试剂、催化剂与溶剂

溶剂HCID962

Water

H2O

PROCEDURE

实验过程

According to the procedure described in Example 1, 52.1 g of bromoacetic acid (0.375 mol) are reacted with 62 g of compound (B) 3-[6- [[[2-[(aminoethyl)amino]ethyl]amino]acetylamino]-1-oxohexyl]amino-α-ethyl-2,4,6-triiodobenzenepropanoic acid (0.075 mol) in 400 ml of H2O. 32.9 g of 18-[[3-(2-carboxybutyl)-2,4,6-triiodophenyl]amino]-3,6,9-tris(carboxymethyl)-11,18-dioxo-3,6,9,12-tetraazaoctadecanoic acid (0.031 mol) are obtained.

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-12e3ee97c06b45208740793005b25f61
来源数据集: uspto-grants-1997_08
DOI: 10.6084/m9.figshare.5104873.v1
专利: US05660814
来源说明: uspto-grants-1997_08

反应 SMILES

Br[CH2:2][C:3]([OH:5])=[O:4].[NH2:6][CH2:7][CH2:8][NH:9][CH2:10][CH2:11][NH:12][CH2:13][C:14]([NH:16][CH2:17][CH2:18][CH2:19][CH2:20][CH2:21][C:22]([NH:24][C:25]1[C:26]([I:40])=[C:27]([CH2:33][CH:34]([CH2:38][CH3:39])[C:35]([OH:37])=[O:36])[C:28]([I:32])=[CH:29][C:30]=1[I:31])=[O:23])=[O:15]>O>[C:35]([CH:34]([CH2:38][CH3:39])[CH2:33][C:27]1[C:26]([I:40])=[C:25]([NH:24][C:22](=[O:23])[CH2:21][CH2:20][CH2:19][CH2:18][CH2:17][NH:16][C:14](=[O:15])[CH2:13][N:12]([CH2:2][C:3]([OH:5])=[O:4])[CH2:11][CH2:10][N:9]([CH2:2][C:3]([OH:5])=[O:4])[CH2:8][CH2:7][N:6]([CH2:2][C:3]([OH:5])=[O:4])[CH2:2][C:3]([OH:5])=[O:4])[C:30]([I:31])=[CH:29][C:28]=1[I:32])([OH:37])=[O:36]