PDB CCD ID: | FH8 |
Number of entries in BioLiP: | 0 |
Chemical formula: | C25 H23 N2 O5 |
InChI: | InChI=1S/C25H22N2O5/c1-26(2)15-6-9-18-21(12-15)32-22-13-16(27(3)4)7-10-19(22)23(18)17-8-5-14(24(28)29)11-20(17)25(30)31/h5-13H,1-4H3,(H-,28,29,30,31)/p+1 |
InChIKey: | YMZMTOFQCVHHFB-UHFFFAOYSA-O |
SMILES: | Software | SMILES |
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CACTVS 3.385 | CN(C)c1ccc2c(OC3=CC(C=CC3=C2c4ccc(cc4C(O)=O)C(O)=O)=[N+](C)C)c1 | OpenEye OEToolkits 2.0.6 | CN(C)c1ccc2c(c1)OC3=CC(=[N+](C)C)C=CC3=C2c4ccc(cc4C(=O)O)C(=O)O |
|
Name: | 5-carboxy methylrhodamine |
ZINC: | ZINC000022054130 |