Acetic Acid → HCID 58760945, compound

HRID 1139317Notes

Reaction equation

HRID 1139317 reaction equation
[C:1]([O:2][BH-:3]([O:4][C:5](=[O:6])[CH3:7])[O:8][C:9](=[O:10])[CH3:11])(=[O:12])[CH3:13].[CH2:15]([CH3:16])[O:17][C:18](=[O:19])[c:20]1[n:21][c:22](-[c:35]2[cH:36][cH:37][c:38]([Cl:41])[cH:39][cH:40]2)[n:23](-[c:28]2[c:29]([Cl:34])[cH:30][cH:31][cH:32][cH:33]2)[c:24]1[CH2:25][CH:26]=[O:27].[CH3:48][C:49](=[O:50])[OH:51].[CH:42]1([NH2:47])[CH2:43][CH2:44][CH2:45][CH2:46]1.[Na+:14]>>[CH2:15]([CH3:16])[O:17][C:18](=[O:19])[c:20]1[n:21][c:22](-[c:35]2[cH:36][cH:37][c:38]([Cl:41])[cH:39][cH:40]2)[n:23](-[c:28]2[c:29]([Cl:34])[cH:30][cH:31][cH:32][cH:33]2)[c:24]1[CH2:25][CH2:26][NH:47][CH:42]1[CH2:43][CH2:44][CH2:45][CH2:46]1

Participants

6

Reactant 5

HCID 176Acetic AcidHCID 923Sodium ionHCID 2906CyclopentylamineHCID 2724942TriacetoxyborohydrideHCID 58760944HCID 58760944, compound

Product 1

HCID 58760945HCID 58760945, compound

Sources & evidence

ORD record
ord-713c49c806fa41ada15971479347db61
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (7/10)

Reaction notes

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