Sodium ion → [(6-Chloro-4-hydroxy-2-oxo-1-pyridin-3-ylmethyl-1,2-dihydro-pyrrolo[1,2-b]pyridazine-3-carbonyl)-amino]-acetic acid

HRID 158045

반응식

HRID 158045 반응식
[CH3:1][O:2][C:3](=[O:4])[c:5]1[c:6]([OH:23])[c:7]2[n:8]([n:9]([CH2:12][c:13]3[cH:14][n:15][cH:16][cH:17][cH:18]3)[c:10]1=[O:11])[cH:19][c:20]([Cl:22])[cH:21]2.[NH2:24][CH2:25][C:26](=[O:27])[O-:28].[Na+:29]>>[C:3](=[O:4])([c:5]1[c:6]([OH:23])[c:7]2[n:8]([n:9]([CH2:12][c:13]3[cH:14][n:15][cH:16][cH:17][cH:18]3)[c:10]1=[O:11])[cH:19][c:20]([Cl:22])[cH:21]2)[NH:24][CH2:25][C:26](=[O:27])[OH:28]

참가 물질

4

반응물 3

HCID 923Sodium ionHCID 26066GlycinateHCID 672307786-Chloro-4-hydroxy-2-oxo-1-pyridin-3-ylmethyl-1,2-dihydro-pyrrolo[1,2-b]pyridazine-3-carboxylic acid methyl ester

생성물 1

HCID 54751168[(6-Chloro-4-hydroxy-2-oxo-1-pyridin-3-ylmethyl-1,2-dihydro-pyrrolo[1,2-b]pyridazine-3-carbonyl)-amino]-acetic acid

출처 및 근거

ORD 기록
ord-fa649978ff794ddb97e0a79b3d8d1556
출처 데이터셋
Training data from https://doi.org/10.1039/C8SC04228D (9/10)

연결된 노트

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