Acetic Acid → HCID 178489406, compound

HRID 1113964Notes

Reaction equation

HRID 1113964 reaction equation
[C:38]([BH3-:39])#[N:40].[CH2:42]1[CH2:43][O:44][CH2:45][CH2:46][NH:47]1.[CH3:48][C:49](=[O:50])[OH:51].[CH3:52][OH:53].[F:1][c:2]1[c:3]([NH:30][CH:31]2[CH2:32][CH2:33][C:34](=[O:37])[CH2:35][CH2:36]2)[c:4]([C:5](=[O:6])[N:7]([CH3:8])[CH3:9])[cH:10][c:11](-[c:13]2[cH:14][c:15]3[c:16]([n:17][cH:18]2)[nH:19][n:20][c:21]3-[c:22]2[c:23]([O:28][CH3:29])[cH:24][cH:25][cH:26][cH:27]2)[cH:12]1.[Na+:41].[OH2:54]>>[F:1][c:2]1[c:3]([NH:30][CH:31]2[CH2:32][CH2:33][CH:34]([N:47]3[CH2:42][CH2:43][O:44][CH2:45][CH2:46]3)[CH2:35][CH2:36]2)[c:4]([C:5](=[O:6])[N:7]([CH3:8])[CH3:9])[cH:10][c:11](-[c:13]2[cH:14][c:15]3[c:16]([n:17][cH:18]2)[nH:19][n:20][c:21]3-[c:22]2[c:23]([O:28][CH3:29])[cH:24][cH:25][cH:26][cH:27]2)[cH:12]1

Participants

8

Reactant 7

HCID 176Acetic AcidHCID 887MethanolHCID 923Sodium ionHCID 962WaterHCID 8083MorpholineHCID 498716Cyano-borohydrideHCID 178489407HCID 178489407, compound

Product 1

HCID 178489406HCID 178489406, compound

Sources & evidence

ORD record
ord-eee0150a905848d8951704da40b546bf
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (7/10)

Reaction notes

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