HCID 18922883, compound → HCID 178455597, compound

HRID 1555430Notes

Reaction equation

HRID 1555430 reaction equation
[C:1]([CH3:2])([CH3:3])([CH3:4])[S:5](=[O:6])(=[O:7])[CH2:8][CH:9]([C:10](=[O:11])[NH:12][CH:13]([CH2:14][c:15]1[cH:16][n:17](-[c:20]2[c:21]([N+:29](=[O:30])[O-:31])[cH:22][c:23]([N+:26](=[O:27])[O-:28])[cH:24][cH:25]2)[cH:18][n:19]1)[C:32](=[O:33])[OH:34])[CH2:35][c:36]1[cH:37][cH:38][cH:39][cH:40][cH:41]1.[NH2:42][CH:43]([CH:44]([CH:45]([OH:46])[CH:47]1[CH2:48][CH2:49]1)[OH:50])[CH2:51][CH:52]1[CH2:53][CH2:54][CH2:55][CH2:56][CH2:57]1>>[C:1]([CH3:2])([CH3:3])([CH3:4])[S:5](=[O:6])(=[O:7])[CH2:8][CH:9]([C:10](=[O:11])[NH:12][CH:13]([CH2:14][c:15]1[cH:16][n:17](-[c:20]2[c:21]([N+:29](=[O:30])[O-:31])[cH:22][c:23]([N+:26](=[O:27])[O-:28])[cH:24][cH:25]2)[cH:18][n:19]1)[C:32](=[O:33])[NH:42][CH:43]([CH:44]([CH:45]([OH:46])[CH:47]1[CH2:48][CH2:49]1)[OH:50])[CH2:51][CH:52]1[CH2:53][CH2:54][CH2:55][CH2:56][CH2:57]1)[CH2:35][c:36]1[cH:37][cH:38][cH:39][cH:40][cH:41]1

Participants

3

Reactant 2

HCID 18922883HCID 18922883, compoundHCID 178455598HCID 178455598, compound

Product 1

HCID 178455597HCID 178455597, compound

Sources & evidence

ORD record
ord-12c9ff83c8e94a35a367e7863039ede7
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (1/10)

Reaction notes

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