4-((5,6,7,8-Tetrahydro-8,8-dimethyl-5-oxonaphth-2-yl)ethynyl]benzoic acid → 6-[(5,6,7,8-Tetrahydro-8,8-dimethyl-5-oxonaphth-3-yl)ethynyl]nicotinic acid

HRID 678070

Reaktionsgleichung

Reaktionsgleichung von HRID 678070
[CH3:1][C:2]1([CH3:3])[c:4]2[cH:5][c:6]([C:7]#[C:8][c:9]3[cH:10][cH:11][c:12]([C:13]([OH:14])=[O:15])[cH:16][cH:17]3)[cH:18][cH:19][c:20]2[C:21](=[O:22])[CH2:23][CH2:24]1.[CH3:25][C:26]1([CH3:50])[CH2:27][CH2:28][C:29](=[O:49])[c:30]2[cH:31][c:32]([C:36]#[C:37][c:38]3[n:39][cH:40][c:41]([C:42](=[O:43])[O:44][CH2:45][CH3:46])[cH:47][cH:48]3)[cH:33][cH:34][c:35]21>>[CH3:25][C:26]1([CH3:50])[CH2:27][CH2:28][C:29](=[O:49])[c:30]2[cH:31][c:32]([C:36]#[C:37][c:38]3[n:39][cH:40][c:41]([C:42](=[O:43])[OH:44])[cH:47][cH:48]3)[cH:33][cH:34][c:35]21

Komponenten

3

Edukt 2

HCID 153455474-((5,6,7,8-Tetrahydro-8,8-dimethyl-5-oxonaphth-2-yl)ethynyl]benzoic acidHCID 15391668Ethyl 6-[(5,6,7,8-tetrahydro-8,8-dimethyl-5-oxonaphth-3-yl)ethynyl]nicotinate

Produkt 1

HCID 183145816-[(5,6,7,8-Tetrahydro-8,8-dimethyl-5-oxonaphth-3-yl)ethynyl]nicotinic acid

Quellen und Nachweise

ORD-Eintrag
ord-e310f5e4b84b45b9b19ee1665bafc456
Quelldatensatz
Training data from https://doi.org/10.1039/C8SC04228D (3/10)

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