Chemical Component Summary

Name(2S)-3-(3-hydroxyphenyl)-2-(4-iodophenyl)-4-methyl-2H-1-benzopyran-6-ol
Identifiers(2~{S})-3-(3-hydroxyphenyl)-2-(4-iodophenyl)-4-methyl-2~{H}-chromen-6-ol
FormulaC22 H17 I O3
Molecular Weight456.273
TypeNON-POLYMER
Isomeric SMILESCC1=C([C@@H](Oc2c1cc(cc2)O)c3ccc(cc3)I)c4cccc(c4)O
InChIInChI=1S/C22H17IO3/c1-13-19-12-18(25)9-10-20(19)26-22(14-5-7-16(23)8-6-14)21(13)15-3-2-4-17(24)11-15/h2-12,22,24-25H,1H3/t22-/m0/s1
InChIKeyRWKXMXMLZHFKIZ-QFIPXVFZSA-N

Chemical Details

Formal Charge0
Atom Count43
Chiral Atom Count1
Bond Count46
Aromatic Bond Count18

Related Resource References

Resource NameReference
PubChem 137332066