Methanol → HCID 178440210, compound

HRID 140598Notes

Reaction equation

HRID 140598 reaction equation
[CH3:76][OH:77].[CH:1]([CH3:2])([CH3:3])[CH:4]1[C:5](=[O:72])[NH:6][CH2:7][C:8](=[O:71])[O:9][CH:10]([CH:47]=[CH:48][CH2:49][CH2:50][S:51][C:52]([c:53]2[cH:54][cH:55][cH:56][cH:57][cH:58]2)([c:59]2[cH:60][cH:61][cH:62][cH:63][cH:64]2)[c:65]2[cH:66][cH:67][cH:68][cH:69][cH:70]2)[CH2:11][C:12](=[O:46])[NH:13][CH:14]([CH:43]([CH3:44])[CH3:45])[C:15](=[O:42])[NH:16][CH:17]([CH2:21][S:22][C:23]([c:24]2[cH:25][cH:26][cH:27][cH:28][cH:29]2)([c:30]2[cH:31][cH:32][cH:33][cH:34][cH:35]2)[c:36]2[cH:37][cH:38][cH:39][cH:40][cH:41]2)[C:18](=[O:20])[NH:19]1.[Cl:73][CH2:74][Cl:75]>>[CH:1]([CH3:2])([CH3:3])[CH:4]1[C:5](=[O:72])[NH:6][CH2:7][C:8](=[O:71])[O:9][CH:10]2[CH2:11][C:12](=[O:46])[NH:13][CH:14]([CH:43]([CH3:44])[CH3:45])[C:15](=[O:42])[NH:16][CH:17]([C:18](=[O:20])[NH:19]1)[CH2:21][S:22][S:51][CH2:50][CH2:49][CH:48]=[CH:47]2

Participants

4

Sources & evidence

ORD record
ord-96951db23b4f4c2283c8cea1d5767613
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (9/10)

Reaction notes

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