Bicarbonate Ion → HCID 11684535, compound

HRID 157910Notes

Reaction equation

HRID 157910 reaction equation
[CH2:46]1[O:47][CH2:48][CH2:49][CH2:50]1.[CH3:1][c:2]1[c:3]([C:9](=[O:10])[N:11]2[CH2:12][CH:13]3[CH2:14][NH:15][CH2:16][CH:17]3[CH2:18]2)[c:4]([CH3:8])[cH:5][cH:6][cH:7]1.[CH3:51][CH:52]([CH3:53])[O-:54].[CH3:55][CH:56]([CH3:57])[O-:58].[CH3:59][CH:60]([CH3:61])[O-:62].[CH3:63][CH:64]([CH3:65])[O-:66].[Cl:43][CH2:44][Cl:45].[Na+:42].[O-:38][C:39]([OH:40])=[O:41].[O:19]=[C:20]([CH2:21][CH:22]([c:23]1[cH:24][cH:25][cH:26][cH:27][cH:28]1)[NH:29][C:30](=[O:31])[CH:32]1[CH2:33][CH2:34][CH2:35][CH2:36]1)[CH3:37].[Ti+4:67]>>[CH3:1][c:2]1[c:3]([C:9](=[O:10])[N:11]2[CH2:12][CH:13]3[CH2:14][N:15]([CH:20]([CH2:21][CH:22]([c:23]4[cH:24][cH:25][cH:26][cH:27][cH:28]4)[NH:29][C:30](=[O:31])[CH:32]4[CH2:33][CH2:34][CH2:35][CH2:36]4)[CH3:37])[CH2:16][CH:17]3[CH2:18]2)[c:4]([CH3:8])[cH:5][cH:6][cH:7]1

Participants

9

Reactant 8

HCID 769Bicarbonate IonHCID 923Sodium ionHCID 6344DichloromethaneHCID 8028TetrahydrofuranHCID 114942Titanium cation (4+)HCID 3260420Isopropanolate4×HCID 21076152HCID 21076152, compoundHCID 69436264HCID 69436264, compound

Product 1

HCID 11684535HCID 11684535, compound

Sources & evidence

ORD record
ord-ab520cf3f28e42eda5562a0d9008a47e
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (9/10)

Reaction notes

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