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Hydrochloric Acid → HCID 178496826, compound

HRID 682720
Notes
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Reaction equation

HRID 682720 reaction equation
[C:1](=[O:2])([O:3][C:4]([CH3:5])([CH3:6])[CH3:7])[NH:8][CH:9]([CH2:10][CH2:11][S:12][CH3:13])[C:14](=[O:15])[OH:16].[CH2:24]([O:25][C:26]([Cl:27])=[O:28])[CH:29]([CH3:30])[CH3:31].[CH3:17][N:18]1[CH2:19][CH2:20][O:21][CH2:22][CH2:23]1.[CH3:68][CH2:69][O:70][C:71](=[O:72])[CH3:73].[ClH:32].[NH2:33][CH2:34][C:35](=[O:36])[NH:37][CH:38]([CH2:39][c:40]1[cH:41][cH:42][cH:43][cH:44][cH:45]1)[C:46](=[O:47])[CH:48]1[C:49]2([C:59](=[O:60])[O:61][CH3:62])[CH2:50][CH:51]3[CH2:52][CH:53]([CH2:54][C:55]1([NH2:57])[CH2:56]3)[CH2:58]2.[O:63]1[CH2:64][CH2:65][CH2:66][CH2:67]1>>[C:1](=[O:2])([O:3][C:4]([CH3:5])([CH3:6])[CH3:7])[NH:8][CH:9]([CH2:10][CH2:11][S:12][CH3:13])[C:14](=[O:16])[NH:33][CH2:34][C:35](=[O:36])[NH:37][CH:38]([CH2:39][c:40]1[cH:41][cH:42][cH:43][cH:44][cH:45]1)[C:46](=[O:47])[CH:48]1[C:49]2([C:59](=[O:60])[O:61][CH3:62])[CH2:50][CH:51]3[CH2:52][CH:53]([CH2:54][C:55]1([NH2:57])[CH2:56]3)[CH2:58]2
ParticipantsSources & evidenceReaction notes

Participants

8

Reactant 7

HCID 313Hydrochloric AcidHCID 79724-MethylmorpholineHCID 8028TetrahydrofuranHCID 8857Ethyl AcetateHCID 62365Isobutyl chloroformateHCID 102827tert-butoxycarbonyl-L-methionine
HCID 178496823
methyl 3-amino-2-[2-[(2-aminoacetyl)amino]-3-phenylpropanoyl]adamantane-1-carboxylate

Product 1

HCID 178496826HCID 178496826, compound

Sources & evidence

ORD record
ord-b6e6602afb8d47b194e4cc72a2df0bed
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (3/10)
DOI
10.1039/C8SC04228D

Reaction notes

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On this pageParticipantsSources & evidenceReaction notes