Dataset

13C nuclear magnetic resonance spectroscopy (13C NMR)

dataset for 13C nuclear magnetic resonance spectroscopy (13C NMR)

Chemical Information

molecular Image
InChI InChI=1S/C27H48O3Si/c1-18(28)29-20-13-15-26(5)19(17-20)9-10-21-22-11-12-24(27(22,6)16-14-23(21)26)30-31(7,8)25(2,3)4/h19-24H,9-17H2,1-8H3/t19-,20-,21-,22-,23-,24-,26-,27-/m0/s1
SMILES CC(=O)O[C@H]1CC[C@]2([C@H](C1)CC[C@@H]1[C@@H]2CC[C@]2([C@H]1CC[C@@H]2O[Si](C(C)(C)C)(C)C)C)C
InChI Key BHHGIJMSPJSWNB-WOUSRVCJSA-N
Molecular Formula C27H48O3Si
Exact Mass 448.754 g/mol

Data and Resources

Metadata Information

Field Value
DOI 10.14272/BHHGIJMSPJSWNB-WOUSRVCJSA-N/CHMO0000595
License URL
Source https://www.chemotion-repository.net/inchikey/BHHGIJMSPJSWNB-WOUSRVCJSA-N/CHMO0000595
Version
Author Vanessa Koch
Maintainer Chemotion Repository
Language english
MetadataPublished 2025-05-21
Related Molecule
  • [(3S,5S,8R,9S,10S,13S,14S,17S)-17-[tert-butyl(dimethyl)silyl]oxy-10,13-dimethyl-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthren-3-yl] acetate
    • Field Value
    Measurement Technique 13C nuclear magnetic resonance spectroscopy
    Measurement Variables
    Data-Source Molecule ID Data-Source
    175646779 pubchem
    The data in this table is sourced from UniChem at EBI.