Ionomycin

CAS Registry Number®

56092-81-0

CAS Name

Ionomycin

Molecular Formula

C41H72O9

Molecular Mass

709.01

Cite this Page

Ionomycin.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=56092-81-0 (retrieved 2024-11-21) (CAS RN: 56092-81-0).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C41H72O9/c1-25(21-29(5)34(43)24-35(44)30(6)22-27(3)20-26(2)14-15-38(46)47)12-11-13-28(4)39(48)31(7)36(45)23-33-16-18-41(10,49-33)37-17-19-40(9,50-37)32(8)42/h11,13,24-33,36-37,39,42-43,45,48H,12,14-23H2,1-10H3,(H,46,47)/b13-11+,34-24-/t25-,26-,27+,28-,29-,30+,31+,32-,33+,36+,37-,39-,40+,41+/m1/s1

InChIKey

InChIKey=PGHMRUGBZOYCAA-ADZNBVRBSA-N

SMILES

C[C@@]1(O[C@H](C[C@@H]([C@@H]([C@@H]([C@@H](/C=C/C[C@H](C[C@H](/C(=C/C([C@H](C[C@H](C[C@@H](CCC(O)=O)C)C)C)=O)/O)C)C)C)O)C)O)CC1)[C@@]2(O[C@@]([C@@H](C)O)(C)CC2)[H]

Canonical SMILES

O=C(O)CCC(C)CC(C)CC(C(=O)C=C(O)C(C)CC(C)CC=CC(C)C(O)C(C)C(O)CC1OC(C)(CC1)C2OC(C)(CC2)C(O)C)C

Other Names for this Substance

  • 10,16-Docosadienoic acid, 11,19,21-trihydroxy-4,6,8,12,14,18,20-heptamethyl-22-[(2S,2′R,5S,5′S)-octahydro-5′-[(1R)-1-hydroxyethyl]-2,5′-dimethyl[2,2′-bifuran]-5-yl]-9-oxo-, (4R,6S,8S,10Z,12R,14R,16E,18R,19R,20S,21S)-
  • Ionomycin
  • (4R,6S,8S,10Z,12R,14R,16E,18R,19R,20S,21S)-11,19,21-Trihydroxy-4,6,8,12,14,18,20-heptamethyl-22-[(2S,2′R,5S,5′S)-octahydro-5′-[(1R)-1-hydroxyethyl]-2,5′-dimethyl[2,2′-bifuran]-5-yl]-9-oxo-10,16-docosadienoic acid
  • 10,16-Docosadienoic acid, 11,19,21-trihydroxy-4,6,8,12,14,18,20-heptamethyl-22-[octahydro-5′-(1-hydroxyethyl)-2,5′-dimethyl[2,2′-bifuran]-5-yl]-9-oxo-, [2S-[2α[2′S*,5′R*(S*)],5β(4S*,6R*,8R*,10Z,12S*,14S*,16E,18S*,19S*,20R*,21R*)]]-
  • [2S-[2α[2′S*,5′R*(S*)],5β(4S*,6R*,8R*,10Z,12S*,14S*,16E,18S*,19S*,20R*,21R*)]]-11,19,21-Trihydroxy-4,6,8,12,14,18,20-heptamethyl-22-[octahydro-5′-(1-hydroxyethyl)-2,5′-dimethyl[2,2′-bifuran]-5-yl]-9-oxo-10,16-docosadienoic acid

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CAS INSIGHTSTM
Targeted protein degrader structure, illustration