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-, calcium salt (1:1), (4R,6S,8S,10Z,12R,14R,16E,18R,19R,20S,21S)-

CAS Registry Number®

56092-82-1

CAS Name

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-, calcium salt (1:1), (4R,6S,8S,10Z,12R,14R,16E,18R,19R,20S,21S)-

Molecular Formula

C41H72O9.Ca

Molecular Mass

749.08

Cite this Page

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-, calcium salt (1:1), (4R,6S,8S,10Z,12R,14R,16E,18R,19R,20S,21S)-.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=56092-82-1 (retrieved 2025-03-15) (CAS RN: 56092-82-1).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Melting Point (1)

    199-200 °C

Source(s)

Other Names and Identifiers

InChI

InChI=1S/C41H72O9.Ca/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=MERVBOMMKAULKQ-WYGBAUISSA-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].[Ca]

Canonical SMILES

[Ca].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-, calcium salt (1:1), (4R,6S,8S,10Z,12R,14R,16E,18R,19R,20S,21S)-
  • Ionomycin, calcium salt (1:1)
  • Calcium ionomycin

Deleted or Replaced CAS Registry Numbers

1214981-98-2, 1263196-82-2

CAS INSIGHTSTM
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