Ethanol → HCID 58540128, 화합물

HRID 197234노트

반응식

HRID 197234 반응식
[CH2:17]1[O:18][CH2:19][CH2:20][CH2:21]1.[CH3:1][C:2]1([CH3:16])[C:3](=[O:15])[c:4]2[c:5]([s:6][c:7]([C:9](=[O:10])[O:11][CH2:12][CH3:13])[cH:8]2)[CH2:14]1.[CH3:22][CH2:23][OH:24].[Li+:25].[OH-:26].[OH2:27]>>[CH3:1][C:2]1([CH3:16])[C:3](=[O:15])[c:4]2[c:5]([s:6][c:7]([C:9](=[O:10])[OH:11])[cH:8]2)[CH2:14]1

참가 물질

7

반응물 6

HCID 702EthanolHCID 961HydroxideHCID 962WaterHCID 8028TetrahydrofuranHCID 28486Lithium ionHCID 58539987Ethyl 5,5-Dimethyl-4-oxo-5,6-dihydro-4H-cyclopenta[b]thiophene-2-carboxylate

생성물 1

HCID 58540128HCID 58540128, 화합물

출처 및 근거

ORD 기록
ord-cf7b2373d56f46b59f0971c01779e0c3
출처 데이터셋
Training data from https://doi.org/10.1039/C8SC04228D (6/10)

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