Chemical Compound

Isodonal

CAS Registry Number 16964-56-0
Isodonal chemical structure
Primary Record

Isodonal

In stock
8,838 g
Purity
99.8 %
CAS
16964-56-0

Compound Identifiers & Properties

CAS
16964-56-0
PubChem CID
14395549
SMILES
CC(=O)O[C@H]1CCC([C@H]([C@@]12COC(=O)[C@]34[C@H]2[C@H](C[C@H](C3)C(=C)C4=O)O)C=O)(C)C
Canonical SMILES
C=C1C(=O)[C@]23C[C@H]1C[C@H](O)[C@H]2[C@]1(COC3=O)[C@@H](OC(C)=O)CCC(C)(C)[C@H]1C=O

Names & Synonyms

  • Isodonal
  • 16964-56-0
  • orb1984189
  • SCHEMBL7763454
  • HY-N8646
  • ZINC34287842
  • AKOS040761881
  • CID 442047
  • FS-7749
  • DA-54415
  • CS-0148808
  • [(1S,1'S,3'R,5S,6S,7S,9S)-3'-formyl-7-hydroxy-4',4'-dimethyl-10-methylidene-2,11-dioxospiro[3-oxatricyclo[7.2.1.01,6]dodecane-5,2'-cyclohexane]-1'-yl] acetate
  • (1S,2R,4/'abeta,6S,7/'S,9/'aS)-6-(Acetyloxy)-4/'a,5/',6/',7/',8/',9/'-hexahydro-5/'beta-hydroxy-3,3-dimethyl-8/'-ethylidene-1/',9/'-dioxospiro[cyclohexane-1,4/'(3/'H)-[1H-7,9a]methanocyclohepta[c]pyran]-2-carbaldehyde