Hydrochloric Acid → HCID 59432488, compound

HRID 1572039Notes

Reaction equation

HRID 1572039 reaction equation
[BH4-:38].[Br:9][c:10]1[cH:11][c:12]2[c:13]([cH:26][cH:27]1)[N:14]([C:20](=[O:21])[O:22][CH:23]([CH3:24])[CH3:25])[CH2:15][CH2:16][CH2:17][C:18]2=[O:19].[CH3:36][OH:37].[CH3:40][CH:41]([CH3:42])[O-:43].[CH3:45][CH:46]([CH3:47])[O-:48].[CH3:49][CH:50]([CH3:51])[O-:52].[CH3:53][CH:54]([CH3:55])[O-:56].[ClH:1].[NH2:2][c:3]1[cH:4][c:5]([CH3:8])[n:6][s:7]1.[Na+:29].[Na+:39].[O:31]1[CH2:32][CH2:33][CH2:34][CH2:35]1.[OH-:28].[OH2:30].[Ti+4:44]>>[NH:2]([c:3]1[cH:4][c:5]([CH3:8])[n:6][s:7]1)[CH:18]1[c:12]2[cH:11][c:10]([Br:9])[cH:27][cH:26][c:13]2[N:14]([C:20](=[O:21])[O:22][CH:23]([CH3:24])[CH3:25])[CH2:15][CH2:16][CH2:17]1

Participants

12

Reactant 11

HCID 313Hydrochloric AcidHCID 887MethanolHCID 923Sodium ion2×HCID 961HydroxideHCID 962WaterHCID 8028TetrahydrofuranHCID 28123BorohydrideHCID 323073-Methylisothiazol-5-amineHCID 114942Titanium cation (4+)HCID 3260420Isopropanolate4×HCID 59432371HCID 59432371, compound

Product 1

HCID 59432488HCID 59432488, compound

Sources & evidence

ORD record
ord-03ff72d91f4b49fcb11cc4f3c8348fe2
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (1/10)

Reaction notes

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