4-Carboxyphenylboronic Acid → Sodium (E)-2-((E)-2-(2-(4-Carboxyphenyl)-3-((E)-2-(3,3-dimethyl-7-(3-sulfonatopropyl)-3H-pyrrolo[2,3-b]pyridin-7-ium-2-yl)vinyl)cyclohex-2-enylidene)ethylidene)-3,3-dimethyl-1-(3-sulfonatopropyl)indoline-5-sulfonate

HRID 1480510Notes

Reaction equation

HRID 1480510 reaction equation
[C:1]([C:4]1[CH:9]=[CH:8][C:7](B(O)O)=[CH:6][CH:5]=1)([OH:3])=[O:2].Cl[C:14]1=[C:15]([CH:40]=[CH:41][C:42]2[C:50]([CH3:52])([CH3:51])[C:49]3[C:44](=[CH:45][CH:46]=[C:47]([S:53]([O-:56])(=[O:55])=[O:54])[CH:48]=3)[N+:43]=2[CH2:57][CH2:58][CH2:59][S:60]([O-:63])(=[O:62])=[O:61])[CH2:16][CH2:17][CH2:18]/[C:19]/1=[CH:20]\[CH:21]=[C:22]1/[C:23]([CH3:39])([CH3:38])[C:24]2[C:25](=[N:37]/1)[N:26]([CH2:30][CH2:31][CH2:32][S:33]([O-:36])(=[O:35])=[O:34])[CH:27]=[CH:28][CH:29]=2.[Na+:64].[Na+]>>[C:1]([C:4]1[CH:9]=[CH:8][C:7]([C:14]2/[C:15](=[CH:40]/[CH:41]=[C:42]3/[N:43]([CH2:57][CH2:58][CH2:59][S:60]([O-:63])(=[O:62])=[O:61])[C:44]4[C:49]([C:50]/3([CH3:51])[CH3:52])=[CH:48][C:47]([S:53]([O-:56])(=[O:54])=[O:55])=[CH:46][CH:45]=4)/[CH2:16][CH2:17][CH2:18][C:19]=2[CH:20]=[CH:21][C:22]2[C:23]([CH3:39])([CH3:38])[C:24]3[C:25]([N:37]=2)=[N+:26]([CH2:30][CH2:31][CH2:32][S:33]([O-:36])(=[O:35])=[O:34])[CH:27]=[CH:28][CH:29]=3)=[CH:6][CH:5]=1)([OH:3])=[O:2].[Na+:64].[Na+:64]

Participants

3

Reactant 2

HCID 3121834-Carboxyphenylboronic AcidHCID 178422058HCID 178422058, compound

Product 1

HCID 57329961Sodium (E)-2-((E)-2-(2-(4-Carboxyphenyl)-3-((E)-2-(3,3-dimethyl-7-(3-sulfonatopropyl)-3H-pyrrolo[2,3-b]pyridin-7-ium-2-yl)vinyl)cyclohex-2-enylidene)ethylidene)-3,3-dimethyl-1-(3-sulfonatopropyl)indoline-5-sulfonate

Procedure

Compound 17 is prepared analogously to compound 10 (Example 10), except that 4-carboxyphenylboronic acid and compound 16 are used as starting materials.

Sources & evidence

ORD record
ord-950f5597e4ad4fac85eb94597750052f
Source dataset
uspto-grants-2016_08
Patent number
US09408924B2

Reaction notes

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