2-Phenylethanol → HCID 20774311, compound

HRID 2144230Notes

Reaction equation

[CH2:20]([CH2:21][c:22]1[cH:23][cH:24][cH:25][cH:26][cH:27]1)[OH:28].[Cl:86][CH2:87][Cl:88].[N:29]([C:30]([O:31][C:32]([CH3:33])([CH3:34])[CH3:35])=[O:36])=[N:37][C:38]([O:39][C:40]([CH3:41])([CH3:42])[CH3:43])=[O:44].[O:45]1[CH2:46][O:47][c:48]2[c:49]1[cH:50][cH:51][c:52]([S:54](=[O:55])(=[O:56])[N:57]([CH2:58][CH:59]([CH:60]([CH2:61][c:62]1[cH:63][cH:64][c:65]([OH:68])[cH:66][cH:67]1)[NH:69][C:70]([O:71][CH:72]1[CH2:73][O:74][CH:75]3[O:76][CH2:77][CH2:78][CH:79]13)=[O:80])[OH:81])[CH2:82][CH:83]([CH3:84])[CH3:85])[cH:53]2.[c:1]1([P:2]([c:3]2[cH:4][cH:5][cH:6][cH:7][cH:8]2)[c:9]2[cH:10][cH:11][cH:12][cH:13][cH:14]2)[cH:15][cH:16][cH:17][cH:18][cH:19]1>>[CH2:20]([CH2:21][c:22]1[cH:23][cH:24][cH:25][cH:26][cH:27]1)[O:28][c:65]1[cH:64][cH:63][c:62]([CH2:61][CH:60]([CH:59]([CH2:58][N:57]([S:54]([c:52]2[cH:51][cH:50][c:49]3[c:48]([cH:53]2)[O:47][CH2:46][O:45]3)(=[O:55])=[O:56])[CH2:82][CH:83]([CH3:84])[CH3:85])[OH:81])[NH:69][C:70]([O:71][CH:72]2[CH2:73][O:74][CH:75]3[O:76][CH2:77][CH2:78][CH:79]23)=[O:80])[cH:67][cH:66]1

Participants

Reactant 5

HCID 60542-Phenylethanol

HCID 6344Dichloromethane

HCID 11776Triphenylphosphine

HCID 97268Di-tert-butyl azodicarboxylate

HCID 207743092,3,3a,4,5,6a-hexahydrofuro[2,3-b]furan-4-yl N-[4-[1,3-benzodioxol-5-ylsulfonyl(2-methylpropyl)amino]-3-hydroxy-1-(4-hydroxyphenyl)butan-2-yl]carbamate

Product 1

HCID 20774311HCID 20774311, compound

Sources & evidence

ORD record: ord-e952b32669ca4ed0b97e37496a89f1f1
Source dataset: Training data from https://doi.org/10.1039/C8SC04228D (4/10)
DOI: 10.1039/C8SC04228D

Reaction notes

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