Chemical Compound

N,O-Diacetyltomatidine

CAS Registry Number 1181-86-8
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N,O-Diacetyltomatidine chemical structure
Primary Record

N,O-Diacetyltomatidine

In stock
3,426 g
Purity
99.5 %
CAS
1181-86-8

Compound Identifiers & Properties

CAS
1181-86-8
PubChem CID
21573753
SMILES
C[C@H]1CC[C@]2([C@H]([C@H]3[C@@H](O2)C[C@@H]4[C@@]3(CC[C@H]5[C@H]4CC[C@@H]6[C@@]5(CC[C@@H](C6)OC(=O)C)C)C)C)N(C1)C(=O)C
Canonical SMILES
CC(=O)O[C@H]1CC[C@@]2(C)[C@@H](CC[C@@H]3[C@@H]2CC[C@]2(C)[C@@H]4[C@H](C[C@@H]32)O[C@@]2(CC[C@H](C)CN2C(C)=O)[C@H]4C)C1

Names & Synonyms

  • N,O-Diacetyltomatidine
  • J130.679K
  • N-Acetyl-5alpha-tomatidan-3beta-ol acetate
  • (22S,25S)-28-Acetyl-5alpha-spirosolan-3beta-ol acetate
  • 1181-86-8
  • 5.alpha.-Tomatidan-3.beta.-ol, N-acetyl-, acetate (ester)
  • [(1R,2S,4S,5'S,6S,7S,8R,9S,12S,13S,16S,18S)-1'-Acetyl-5',7,9,13-tetramethylspiro[5-oxapentacyclo[10.8.0.02,9.04,8.013,18]icosane-6,2'-piperidine]-16-yl] acetate
  • Spirosolan-3-ol, 28-acetyl-, acetate (ester), (3.beta.,5.alpha.,22.beta.,25S)-
  • (1R,2S,4S,5'S,6S,7S,8R,9S,12S,13S,16S,18S)-1'-acetyl-5',7,9,13-tetramethyl-5-oxaspiro[pentacyclo[10.8.0.02,9.04,8.013,18]icosane-6,2'-piperidin]-16-yl acetate