Skip Navigation
ChemIDplus A TOXNET DATABASE LiteBrowseAdvanced

Substance Name: Neosolaniol 8-propionate
RN: 111112-47-1
InChIKey: ZSGWJLBSFZRJAT-MLXHEQMXSA-N

Molecular Formula

  • C22-H30-O9

Molecular Weight

  • 438.47
 
* denotes mobile formatted website

Links to Resources

NLM Resources (File Locators)

Other Resources (Internet Locators)


Search for this InChIKey on the Web

Names and Synonyms

Results Name

  • Neosolaniol 8-propionate

Synonyms

  • 8-Propionylneosolaniol
  • Neosolaniol 8-propionate

Systematic Name

  • Trichothec-9-ene-3,4,8,15-tetrol, 12,13-epoxy-, 4,15-diacetate 8-propanoate, (3alpha,4beta,8alpha)-

Registry Numbers

CAS Registry Number

  • 111112-47-1

Other Registry Number

  • 116163-71-4

System Generated Number

  • 0111112471

Structure Descriptors

InChI

1S/C22H30O9/c1-6-16(25)30-14-8-21(9-27-12(3)23)15(7-11(14)2)31-19-17(26)18(29-13(4)24)20(21,5)22(19)10-28-22/h7,14-15,17-19,26H,6,8-10H2,1-5H3/t14-,15+,17+,18+,19+,20+,21+,22-/m0/s1

InChIKey

ZSGWJLBSFZRJAT-MLXHEQMXSA-N

Smiles

CCC(=O)O[C@H]1C[C@]2([C@@H](C=C1C)O[C@@H]3[C@@H]([C@H]([C@]2([C@]34CO4)C)OC(=O)C)O)COC(=O)C