Chemical Component Summary | |
|---|---|
| Name | phosphonato-calix[6]arene |
| Formula | C42 H42 O24 P6 |
| Molecular Weight | 1,116.611 |
| Type | NON-POLYMER |
| Isomeric SMILES | c1c(cc2c(c1Cc3cc(cc(c3O)Cc4cc(cc(c4O)Cc5cc(cc(c5O)Cc6cc(cc(c6O)Cc7cc(cc(c7O)C2)P(=O)(O)O)P(=O)(O)O)P(=O)(O)O)P(=O)(O)O)P(=O)(O)O)O)P(=O)(O)O |
| InChI | InChI=1S/C42H42O24P6/c43-37-19-1-20-8-32(68(52,53)54)10-22(38(20)44)3-24-12-34(70(58,59)60)14-26(40(24)46)5-28-16-36(72(64,65)66)18-30(42(28)48)6-29-17-35(71(61,62)63)15-27(41(29)47)4-25-13-33(69(55,56)57)11-23(39(25)45)2-21(37)9-31(7-19)67(49,50)51/h7-18,43-48H,1-6H2,(H2,49,50,51)(H2,52,53,54)(H2,55,56,57)(H2,58,59,60)(H2,61,62,63)(H2,64,65,66) |
| InChIKey | QYHXEDFDCVRPFA-UHFFFAOYSA-N |
Chemical Details | |
|---|---|
| Formal Charge | 0 |
| Atom Count | 114 |
| Chiral Atom Count | 0 |
| Bond Count | 120 |
| Aromatic Bond Count | 36 |
Related Resource References
| Resource Name | Reference |
|---|---|
| PubChem | 25222612 |
