3-(11-(4-((2,5-Dioxopyrrolidin-1-yl)oxy)-4-oxobutyl)-2,2,10,10-tetramethyl-4,8-bis(sulfomethyl)-3,4,8,9,10,11-hexahydro-2H-dipyrido[3,2-b:2',3'-i]phenoxazin-1-ium-1-yl)propane-1-sulfonate

Catalog No. :: ACCARR813
CAS No. :: 1201771-13-2
Molecular Formula :: C35H44N4O14S3
Molecular Weight :: 840.95

IUPAC Name:3-(11-(4-((2,5-dioxopyrrolidin-1-yl)oxy)-4-oxobutyl)-2,2,10,10-tetramethyl-4,8-bis(sulfomethyl)-3,4,8,9,10,11-hexahydro-2H-dipyrido[3,2-b:2',3'-i]phenoxazin-1-ium-1-yl)propane-1-sulfonate

3-(11-(4-((2,5-Dioxopyrrolidin-1-yl)oxy)-4-oxobutyl)-2,2,10,10-tetramethyl-4,8-bis(sulfomethyl)-3,4,8,9,10,11-hexahydro-2H-dipyrido[3,2-b:2',3'-i]phenoxazin-1-ium-1-yl)propane-1-sulfonate structure diagram

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Product Information

Product Name	3-(11-(4-((2,5-Dioxopyrrolidin-1-yl)oxy)-4-oxobutyl)-2,2,10,10-tetramethyl-4,8-bis(sulfomethyl)-3,4,8,9,10,11-hexahydro-2H-dipyrido[3,2-b:2',3'-i]phenoxazin-1-ium-1-yl)propane-1-sulfonate
IUPAC Name	3-(11-(4-((2,5-dioxopyrrolidin-1-yl)oxy)-4-oxobutyl)-2,2,10,10-tetramethyl-4,8-bis(sulfomethyl)-3,4,8,9,10,11-hexahydro-2H-dipyrido[3,2-b:2',3'-i]phenoxazin-1-ium-1-yl)propane-1-sulfonate
Molecular Formula	C35H44N4O14S3
Molecular Weight	840.95
SMILES	CC1(C)CC(CS(=O)(=O)O)C2=CC3=C(C=C2N1CCCC(=O)ON1C(=O)CCC1=O)OC1=CC2=[N+](CCCS(=O)(=O)[O-])C(C)(C)CC(CS(=O)(=O)O)C2=CC1=N3
InChI Key	YAVQXHOUZLJEEO-UHFFFAOYSA-N
Synonym	MB 660R NHS Ester;2H-Dipyrido[3,2-b:2′,3′-i]phenoxazinium, 1-[11-[(2,5-dioxo-1-pyrrolidinyl)oxy]-4-oxobutyl]-3,4,8,9,10,11-hexahydro-2,2,10,10-tetramethyl-4,8-bis(sulfomethyl)-1-(3-sulfopropyl)-, inner salt
CAS No.	1201771-13-2

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ACCARR8131201771-13-2

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ACCARR8131201771-13-2

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3-(11-(4-((2,5-Dioxopyrrolidin-1-yl)oxy)-4-oxobutyl)-2,2,10,10-tetramethyl-4,8-bis(sulfomethyl)-3,4,8,9,10,11-hexahydro-2H-dipyrido[3,2-b:2',3'-i]phenoxazin-1-ium-1-yl)propane-1-sulfonate

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1. ACCARR813 Molecular Building Block Synthetic Route

2. ACCARR813 Molecular Building Block Synthetic Route

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3-(11-(4-((2,5-Dioxopyrrolidin-1-yl)oxy)-4-oxobutyl)-2,2,10,10-tetramethyl-4,8-bis(sulfomethyl)-3,4,8,9,10,11-hexahydro-2H-dipyrido[3,2-b:2',3'-i]phenoxazin-1-ium-1-yl)propane-1-sulfonate

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Synthetic Route by SureRoute

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