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Hydrochloric Acid → 2-{4-[5-(Cyclopropyl-methyl-amino)-4-methoxy-8,8-dimethyl-5,6,7,8-tetrahydro-naphthalen-2-ylethynyl]-phenyl}-propionic acid

HRID 2142578
Notes
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Reaction equation

HRID 2142578 reaction equation
[CH3:1][O:2][C:3]([CH:4]([CH3:5])[c:6]1[cH:7][cH:8][c:9]([C:12]#[C:13][c:14]2[cH:15][c:16]3[c:21]([c:22]([O:24][CH3:25])[cH:23]2)[CH:20]([N:26]([CH3:27])[CH:28]2[CH2:29][CH2:30]2)[CH2:19][CH2:18][C:17]3([CH3:31])[CH3:32])[cH:10][cH:11]1)=[O:33].[CH3:37][OH:38].[ClH:36].[K+:35].[O:39]1[CH2:40][CH2:41][CH2:42][CH2:43]1.[OH-:34]>>[O:2]=[C:3]([CH:4]([CH3:5])[c:6]1[cH:7][cH:8][c:9]([C:12]#[C:13][c:14]2[cH:15][c:16]3[c:21]([c:22]([O:24][CH3:25])[cH:23]2)[CH:20]([N:26]([CH3:27])[CH:28]2[CH2:29][CH2:30]2)[CH2:19][CH2:18][C:17]3([CH3:31])[CH3:32])[cH:10][cH:11]1)[OH:33]
ParticipantsSources & evidenceReaction notes

Participants

7

Reactant 6

HCID 313Hydrochloric AcidHCID 813Potassium CationHCID 887MethanolHCID 961HydroxideHCID 8028TetrahydrofuranHCID 574242452-{4-[5-(Cyclopropyl-methyl-amino)-4-methoxy-8,8-dimethyl-5,6,7,8-tetrahydro-naphthalen-2-ylethynyl]-phenyl}-propionic acid methyl ester

Product 1

HCID 211071292-{4-[5-(Cyclopropyl-methyl-amino)-4-methoxy-8,8-dimethyl-5,6,7,8-tetrahydro-naphthalen-2-ylethynyl]-phenyl}-propionic acid

Sources & evidence

ORD record
ord-32d1acab5ff74db191246bef4ce1dc15
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (4/10)
DOI
10.1039/C8SC04228D

Reaction notes

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On this pageParticipantsSources & evidenceReaction notes