HCID 118492810, compound → HCID 178507561, compound

HRID 2033979Notes

Reaction equation

HRID 2033979 reaction equation
O=C([NH:1][c:2]1[n:28][n:27][c:5]([CH2:6][C@H:7]2[CH2:11][C@@H:10]([c:12]3[s:26][c:15]([NH:16][C:17]([CH2:19][c:20]4[n:25][cH:24][cH:23][cH:22][cH:21]4)=[O:18])[n:14][n:13]3)[CH2:9][CH2:8]2)[cH:4][cH:3]1)Cc5ncccc5>>[NH2:1][c:2]1[n:28][n:27][c:5]([CH2:6][C@H:7]2[CH2:11][C@@H:10]([c:12]3[s:26][c:15]([NH:16][C:17]([CH2:19][c:20]4[n:25][cH:24][cH:23][cH:22][cH:21]4)=[O:18])[n:14][n:13]3)[CH2:9][CH2:8]2)[cH:4][cH:3]1

Participants

6

Reactant 1

HCID 118492810HCID 118492810, compound

Product 1

HCID 178507561HCID 178507561, compound

Reagents, catalysts & solvents 4

HCID 313Hydrochloric AcidReagentHCID 962WaterReagentHCID 962WaterSolventHCID 117669-PhenylanthraceneInternal standard

Conditions

Temperature
22 °C

Sources & evidence

ORD record
ord-491613e6768546688c375e83f7b71d7a
Source dataset
39k HTE dataset from Pfizer
Original link
View source

Reaction notes

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