Chemical Component Summary

NamePhloxine B
SynonymsCyanosine
Identifiers2,4,5,7-tetrakis(bromanyl)-9-[2-carboxy-3,4,5,6-tetrakis(chloranyl)phenyl]-6-oxidanylidene-xanthen-3-olate
FormulaC20 H3 Br4 Cl4 O5
Molecular Weight784.663
TypeNON-POLYMER
Isomeric SMILESc1c2c(c(c(c1Br)[O-])Br)OC3=C(C(=O)C(=CC3=C2c4c(c(c(c(c4Cl)Cl)Cl)Cl)C(=O)O)Br)Br
InChIInChI=1S/C20H4Br4Cl4O5/c21-5-1-3-7(8-9(20(31)32)13(26)15(28)14(27)12(8)25)4-2-6(22)17(30)11(24)19(4)33-18(3)10(23)16(5)29/h1-2,29H,(H,31,32)/p-1
InChIKeyRIVZUHBWXRGVOG-UHFFFAOYSA-M

Chemical Details

Formal Charge-1
Atom Count36
Chiral Atom Count0
Bond Count39
Aromatic Bond Count12

Related Resource References

Resource NameReference
PubChem 137348882