Products 77-59-8
CAS 77-59-8 appears in our catalog under these names: Tomatidine/ 98.38% (existing batch purity), Tomatidine, (3β,5α,22β,25S)-Spirosolan-3-ol, 98%, 98%, Tomatidine, 98.0%, Tomatidine (Standard), 99.83%. Offered by: TargetMol, GLPBio, Biosynth, Chemat, MedChemExpress. Available pack sizes: 5mg, 10mg, 25mg, 100mg, 50mg, 0,002g, 0,001g, 0,005g.
Tomatidine is a 3beta-hydroxy steroid resulting from the substitution of the 3beta-hydrogen of tomatidane by a hydroxy group. It is an azaspiro compound, a 3beta-hydroxy steroid and an oxaspiro compound. It is a conjugate base of a tomatidine(1+). It derives from a hydride of a tomatidane.
Source: ChEBI
| Molecular formula | C27H45NO2 |
|---|---|
| Molecular weight | 415.7 g/mol |
| IUPAC name | (1R,2S,4S,5'S,6S,7S,8R,9S,12S,13S,16S,18S)-5',7,9,13-tetramethylspiro[5-oxapentacyclo[10.8.0.02,9.04,8.013,18]icosane-6,2'-piperidine]-16-ol |
| InChIKey | XYNPYHXGMWJBLV-VXPJTDKGSA-N |
| 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)O)C)C)C)NC1 |
Computed by PubChem (NCBI)