Salinomycin sodium

CAS Registry Number®

55721-31-8

CAS Name

Salinomycin sodium

Molecular Formula

C42H70O11.Na

Cite this Page

Salinomycin sodium.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=55721-31-8 (retrieved 2024-12-22) (CAS RN: 55721-31-8).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Melting Point (1)

    117-118 °C

Source(s)

Other Names and Identifiers

InChI

InChI=1S/C42H70O11.Na/c1-11-29(38(46)47)31-15-14-23(4)36(50-31)27(8)34(44)26(7)35(45)30(12-2)37-24(5)22-25(6)41(51-37)19-16-32(43)42(53-41)21-20-39(10,52-42)33-17-18-40(48,13-3)28(9)49-33;/h16,19,23-34,36-37,43-44,48H,11-15,17-18,20-22H2,1-10H3,(H,46,47);/t23-,24-,25+,26-,27-,28-,29+,30-,31+,32+,33+,34+,36+,37-,39-,40+,41-,42-;/m0./s1

InChIKey

InChIKey=PNDPFHFAPNOECJ-UZHRAPRISA-N

SMILES

O[C@H]1[C@]2(O[C@@]3(O[C@]([C@H](C([C@H]([C@H]([C@H](C)[C@@]4(O[C@@]([C@H](C(O)=O)CC)(CC[C@@H]4C)[H])[H])O)C)=O)CC)([C@@H](C)C[C@H]3C)[H])C=C1)O[C@@](C)(CC2)[C@@]5(O[C@@H](C)[C@](CC)(O)CC5)[H].[Na]

Canonical SMILES

[Na].O=C(O)C(CC)C1OC(C(C)CC1)C(C)C(O)C(C(=O)C(CC)C2OC3(OC4(OC(C)(CC4)C5OC(C)C(O)(CC)CC5)C(O)C=C3)C(C)CC2C)C

Other Names for this Substance

  • Salinomycin, sodium salt (1:1)
  • Salinomycin, monosodium salt
  • 1,6,8-Trioxadispiro[4.1.5.3]pentadecane, salinomycin deriv.
  • Salinomycin sodium salt
  • Sodium salinomycin

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