Sodium ionophore X

CAS Registry Number®

97600-39-0

CAS Name

Sodium ionophore X

Molecular Formula

C60H80O12

Molecular Mass

993.27

Cite this Page

Sodium ionophore X.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=97600-39-0 (retrieved 2024-11-22) (CAS RN: 97600-39-0).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Melting Point (1)

    154-155 °C

Source(s)

Other Names and Identifiers

InChI

InChI=1S/C60H80O12/c1-17-65-49(61)33-69-53-37-21-39-27-46(58(8,9)10)29-41(54(39)70-34-50(62)66-18-2)23-43-31-48(60(14,15)16)32-44(56(43)72-36-52(64)68-20-4)24-42-30-47(59(11,12)13)28-40(55(42)71-35-51(63)67-19-3)22-38(53)26-45(25-37)57(5,6)7/h25-32H,17-24,33-36H2,1-16H3

InChIKey

InChIKey=HZHADWCIBZZJNV-UHFFFAOYSA-N

SMILES

O(CC(OCC)=O)C=1C=2CC=3C(OCC(OCC)=O)=C(CC=4C(OCC(OCC)=O)=C(CC5=C(OCC(OCC)=O)C(CC1C=C(C(C)(C)C)C2)=CC(C(C)(C)C)=C5)C=C(C(C)(C)C)C4)C=C(C(C)(C)C)C3

Canonical SMILES

O=C(OCC)COC=1C2=CC(=CC1CC3=CC(=CC(=C3OCC(=O)OCC)CC=4C=C(C=C(C4OCC(=O)OCC)CC=5C=C(C=C(C5OCC(=O)OCC)C2)C(C)(C)C)C(C)(C)C)C(C)(C)C)C(C)(C)C

Other Names for this Substance

  • Acetic acid, 2,2′,2′′,2′′′-[[5,11,17,23-tetrakis(1,1-dimethylethyl)pentacyclo[19.3.1.13,7.19,13.115,19]octacosa-1(25),3,5,7(28),9,11,13(27),15,17,19(26),21,23-dodecaene-25,26,27,28-tetrayl]tetrakis(oxy)]tetrakis-, tetraethyl ester
  • Pentacyclo[19.3.1.13,7.19,13.115,19]octacosane, acetic acid deriv.
  • 4-tert-Butyl calix[4]arene-O,O′,O′′,O′′′-tetraacetic acid tetraethyl ester
  • 5,11,17,23-Tetra-tert-butyl-25,26,27,28-tetrakis(2-ethoxy-2-oxoethoxy)calix[4]arene
  • 4-tert-Butylcalix[4]arenetetra-O-acetic acid tetraethyl ester

View All

Deleted or Replaced CAS Registry Numbers

112926-37-1, 121105-07-5, 130036-27-0, 473799-70-1, 144760-24-7, 160527-73-1, 200552-63-2, 214361-31-6, 251301-15-2, 110947-75-6

CAS INSIGHTSTM
Targeted protein degrader structure, illustration