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Details

Stereochemistry ACHIRAL
Molecular Formula C42H52N6O10.2C2H4O2
Molecular Weight 921.0004
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 2,2'-((Ethane-1,2-diylbis(oxy))bis(ethane-2,1-diyl))bis(6-((2-(2-(2-aminoethoxy)ethoxy)ethyl)amino)-1H-benzo[de]isoquinoline-1,3(2H)-dione) diacetate

SMILES

CC(O)=O.CC(O)=O.NCCOCCOCCNC1=CC=C2C(=O)N(CCOCCOCCN3C(=O)C4=CC=CC5=C4C(=CC=C5NCCOCCOCCN)C3=O)C(=O)C6=C2C1=CC=C6

InChI

InChIKey=NEWIPXCNYSUTKG-UHFFFAOYSA-N
InChI=1S/C42H52N6O10.2C2H4O2/c43-11-17-53-23-25-55-19-13-45-35-9-7-33-37-29(35)3-1-5-31(37)39(49)47(41(33)51)15-21-57-27-28-58-22-16-48-40(50)32-6-2-4-30-36(10-8-34(38(30)32)42(48)52)46-14-20-56-26-24-54-18-12-44;2*1-2(3)4/h1-10,45-46H,11-28,43-44H2;2*1H3,(H,3,4)

HIDE SMILES / InChI

Approval Year

Name Type Language
2,2'-((Ethane-1,2-diylbis(oxy))bis(ethane-2,1-diyl))bis(6-((2-(2-(2-aminoethoxy)ethoxy)ethyl)amino)-1H-benzo[de]isoquinoline-1,3(2H)-dione) diacetate
Preferred Name English
Code System Code Type Description
PUBCHEM
164883708
Created by admin on Wed Apr 02 04:20:20 GMT 2025 , Edited by admin on Wed Apr 02 04:20:20 GMT 2025
PRIMARY
FDA UNII
XWD88T55VK
Created by admin on Wed Apr 02 04:20:20 GMT 2025 , Edited by admin on Wed Apr 02 04:20:20 GMT 2025
PRIMARY