Chemical Component Summary

Name(2S)-3-{4-[2-(4-{[(2R)-2-hydroxy-3,3-dimethylbutyl]oxy}phenyl)propan-2-yl]phenoxy}propane-1,2-diol
Identifiers(2S)-3-[4-[2-[4-[(2R)-3,3-dimethyl-2-oxidanyl-butoxy]phenyl]propan-2-yl]phenoxy]propane-1,2-diol
FormulaC24 H34 O5
Molecular Weight402.524
TypeNON-POLYMER
Isomeric SMILESCC(C)(C)[C@H](COc1ccc(cc1)C(C)(C)c2ccc(cc2)OC[C@H](CO)O)O
InChIInChI=1S/C24H34O5/c1-23(2,3)22(27)16-29-21-12-8-18(9-13-21)24(4,5)17-6-10-20(11-7-17)28-15-19(26)14-25/h6-13,19,22,25-27H,14-16H2,1-5H3/t19-,22-/m0/s1
InChIKeyNSXHQTLHHLJUGK-UGKGYDQZSA-N

Chemical Details

Formal Charge0
Atom Count63
Chiral Atom Count2
Bond Count64
Aromatic Bond Count12

Related Resource References

Resource NameReference
PubChem 71737796