Molecular properties
- Formula
- C27H42O3
- Molar mass
- 414.63 g·mol−1
- Exact mass
- 414.3134 Da
- 7
- PubChem CID
- 99474
Molecule record
(1S,2S,4S,5'R,6R,7S,8R,9S,12S,13R,16S)-5',7,9,13-tetramethylspiro[5-oxapentacyclo[10.8.0.02,9.04,8.013,18]icos-18-ene-6,2'-oxane]-16-ol
C27H42O3
414.63 g/mol
Loading structure
Functional groups
Alcohol
Alkane / alkyl carbon
Alkene
Ether
Physical properties
No source-backed physical properties are curated for this molecule yet.
Common names and synonyms
- (20R,25R)-Spirost-5-en-3beta-ol
- (25R)-14beta,17beta-spirost-5-en-3beta-ol
- (25R)-Spirost-5-en-3beta-ol
- (25R)-spirost-5-en-3beta-diol
- (3beta,25R)-spirost-5-en-3-ol
- 208-134-3
- 512-04-9
- CHEBI:4629
Show all 24 synonyms
- DIOSGENIN
- DISOGENIN
- DTXCID301324626
- DTXSID00895074
- Diosgenine
- K49P2K8WLX
- MFCD00016887
- NSC-33396
- Nitogenin
- RefChem:5766
- SP 37
- Spirost-5-en-3-ol, (3b,25R)-
- Spirost-5-en-3-ol, (3beta,25R)-
- Spirost-5-en-3beta-ol, (25R)-
- UNII-K49P2K8WLX
- nitrogen in
Structure identifiers
- Canonical SMILES
- C[C@@H]1CC[C@@]2(OC1)O[C@H]1C[C@H]3[C@@H]4CC=C5C[C@@H](O)CC[C@]5(C)[C@H]4CC[C@]3(C)[C@H]1[C@@H]2C
- Isomeric 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=C6[C@@]5(CC[C@@H](C6)O)C)C)C)OC1
- InChI
- InChI=1S/C27H42O3/c1-16-7-12-27(29-15-16)17(2)24-23(30-27)14-22-20-6-5-18-13-19(28)8-10-25(18,3)21(20)9-11-26(22,24)4/h5,16-17,19-24,28H,6-15H2,1-4H3/t16-,17+,19+,20-,21+,22+,23+,24+,25+,26+,27-/m1/s1
- InChIKey
- WQLVFSAGQJTQCK-VKROHFNGSA-N
- PubChem CID
- 99474
Spectroscopy
Tabs appear only for spectra stored with clear provenance.
No redistributable or simulated spectroscopy record is attached yet.
Simulated NMR
On-demand educational prediction for (1S,2S,4S,5'R,6R,7S,8R,9S,12S,13R,16S)-5',7,9,13-tetramethylspiro[5-oxapentacyclo[10.8.0.02,9.04,8.013,18]icos-18-ene-6,2'-oxane]-16-ol; not experimental data.
Simulated EI mass spectrum
On-demand educational fragmentation for (1S,2S,4S,5'R,6R,7S,8R,9S,12S,13R,16S)-5',7,9,13-tetramethylspiro[5-oxapentacyclo[10.8.0.02,9.04,8.013,18]icos-18-ene-6,2'-oxane]-16-ol; not experimental data.
Sources
Molecule identity
Retrieved 8/20/2026. Reuse status is summarized by the badge; open the source for full details.