4-[6-[16-[2-(2,4-dicarboxyphenyl)-5-methoxy-benzofuran-6-yl]-1,4,10,13-tetraoxa-7,16-diazacyclooctadec-7-yl]-5-methoxy-benzofuran-2-yl]benzene-1,3-dicarboxylic acid
Molecular Formula:
C46H46N2O16
InChI: InChI=1/C46H46N2O16/c1-57-41-23-29-21-39(31-5-3-27(43(49)50)19-33(31)45(53)54)63-37(29)25-35(41)47-7-11-59-15-17-61-13-9-48(10-14-62-18-16-60-12-8-47)36-26-38-30(24-42(36)58-2)22-40(64-38)32-6-4-28(44(51)52)20-34(32)46(55)56/h3-6,19-26H,7-18H2,1-2H3,(H,49,50)(H,51,52)(H,53,54)(H,55,56)/f/h49,51,53,55H
InChIKey: InChIKey=YOQMJMHTHWYNIO-GAKLPCTQCJ
SMILES: COC1=C(C=C2C(=C1)C=C(O2)C3=C(C=C(C=C3)C(=O)O)C(=O)O)N4CCOCCOCCN(CCOCCOCC4)C5=C(C=C6C=C(OC6=C5)C7=C(C=C(C=C7)C(=O)O)C(=O)O)OC
Names:
4-[6-[16-[2-(2,4-dicarboxyphenyl)-5-methoxy-benzofuran-6-yl]-1,4,10,13-tetraoxa-7,16-diazacyclooctadec-7-yl]-5-methoxy-benzofuran-2-yl]benzene-1,3-dicarboxylic acid
Registries:
PubChem CID 4250367
PubChem ID 8399465
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