Ammonia → HCID 22464183, compound

HRID 1571634Notes

Reaction equation

HRID 1571634 reaction equation
[C:38](=[O:39])([O-:40])[OH:41].[CH2:44]([OH:45])[CH2:46][CH2:47][CH3:48].[Cl:30][CH2:31][CH2:32][N:33]([CH3:34])[CH2:35][CH2:36][Cl:37].[ClH:29].[NH3:43].[Na+:42].[O:1]1[CH2:2][CH2:3][N:4]([c:7]2[cH:8][cH:9][c:10]([NH:13][C:14](=[O:15])[CH:16]3[CH2:17][O:18][c:19]4[c:20]([c:22]([NH2:28])[cH:23][cH:24][c:25]4[O:26][CH3:27])[CH2:21]3)[cH:11][cH:12]2)[CH2:5][CH2:6]1>>[O:1]1[CH2:2][CH2:3][N:4]([c:7]2[cH:8][cH:9][c:10]([NH:13][C:14](=[O:15])[CH:16]3[CH2:17][O:18][c:19]4[c:20]([c:22]([N:28]5[CH2:31][CH2:32][N:33]([CH3:34])[CH2:35][CH2:36]5)[cH:23][cH:24][c:25]4[O:26][CH3:27])[CH2:21]3)[cH:11][cH:12]2)[CH2:5][CH2:6]1

Participants

8

Reactant 7

HCID 222AmmoniaHCID 2631-ButanolHCID 313Hydrochloric AcidHCID 769Bicarbonate IonHCID 923Sodium ionHCID 4033MechlorethamineHCID 22464174HCID 22464174, compound

Product 1

HCID 22464183HCID 22464183, compound

Sources & evidence

ORD record
ord-363cc79d565349039fa3716a42de6c0a
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (1/10)

Reaction notes

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