Acetate → HCID 178457253, compound

HRID 2135735Notes

Reaction equation

HRID 2135735 reaction equation
[C:13]([O-:14])(=[O:15])[CH3:16].[C:1]([CH3:2])(=[O:3])[O-:4].[C:54](=[O:55])([OH:56])[O-:57].[C:5]([O-:6])(=[O:7])[CH3:8].[C:9]([O-:10])(=[O:11])[CH3:12].[CH2:18]([CH2:19][CH3:20])[N:21]([CH2:22][CH2:23][CH3:24])[CH2:25][C:26](=[O:27])[O:28][CH:29]1[CH:30]2[C:31]3([CH3:51])[CH2:32][CH2:33][CH:34]([OH:50])[CH2:35][CH:36]3[CH2:37][CH2:38][CH:39]2[CH:40]2[CH2:41][CH2:42][CH:43]([C:44]([CH3:45])=[O:46])[C:47]2([CH3:49])[CH2:48]1.[CH3:52][OH:53].[Na+:58].[Pb+4:17].[cH:59]1[cH:60][cH:61][cH:62][cH:63][cH:64]1>>[C:1]([CH3:2])(=[O:3])[O:4][CH2:45][C:44]([CH:43]1[CH2:42][CH2:41][CH:40]2[CH:39]3[CH:30]([CH:29]([O:28][C:26]([CH2:25][N:21]([CH2:18][CH2:19][CH3:20])[CH2:22][CH2:23][CH3:24])=[O:27])[CH2:48][C:47]21[CH3:49])[C:31]1([CH3:51])[CH2:32][CH2:33][CH:34]([OH:50])[CH2:35][CH:36]1[CH2:37][CH2:38]3)=[O:46]

Participants

8

Reactant 7

HCID 175Acetate4×HCID 241BenzeneHCID 769Bicarbonate IonHCID 887MethanolHCID 923Sodium ionHCID 178457250HCID 178457250, compoundHCID 178527690HCID 178527690, compound

Product 1

HCID 178457253HCID 178457253, compound

Sources & evidence

ORD record
ord-f89ba63b99374cc79569aa41bf348f7e
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (4/10)

Reaction notes

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