HRID287725

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID679

Dimethyl sulfoxide

C2H6OS

HCID1004

Phosphoric acid

H3O4P

HCID1061

Phosphate

O4P-3

结构：O=C(O)c1cn(C2CC2)c2cc(N3CCNCC3)c(F)cc2c1=O

HCID2764

Ciprofloxacin

C17H18FN3O3

HCID8471

Triethylamine

C6H15N

PRODUCTS

生成物

结构：O=C(O)c1cn(C2CC2)c2cc(N3CCN(P(=O)(O)O)CC3)c(F)cc2c1=O

HCID15028013

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-ae59ad25bea74dda8e9e76883c0f844b
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (8/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (8/10)

反应 SMILES

[CH3:1][CH2:2][N:3]([CH2:4][CH3:5])[CH2:6][CH3:7].[CH3:37][S:38]([CH3:39])=[O:40].[O-:41][P:42](=[O:43])([O-:44])[O-:45].[OH:8][C:9](=[O:10])[c:11]1[cH:12][n:13]([CH:14]2[CH2:15][CH2:16]2)[c:17]2[cH:18][c:19]([N:20]3[CH2:21][CH2:22][NH:23][CH2:24][CH2:25]3)[c:26]([F:27])[cH:28][c:29]2[c:30]1=[O:31].[P:32]([OH:33])([OH:34])([OH:35])=[O:36]>>[OH:8][C:9](=[O:10])[c:11]1[cH:12][n:13]([CH:14]2[CH2:15][CH2:16]2)[c:17]2[cH:18][c:19]([N:20]3[CH2:21][CH2:22][N:23]([P:32](=[O:33])([OH:34])[OH:35])[CH2:24][CH2:25]3)[c:26]([F:27])[cH:28][c:29]2[c:30]1=[O:31]