Chemical Compound

Sodagnitin E

Sodagnitin E chemical structure
Primary Record

Sodagnitin E

In stock
550 g
Purity
98.1 %

Compound Identifiers & Properties

PubChem CID
10743997
SMILES
C[C@@]12CC[C@@H]3[C@@]([C@H]1CC[C@H]2C4=CC[C@H](O[C@H]4O)C(=C)C5=CC(=O)C(O5)(C)C)(C[C@H]([C@@H](C3(C)C)O)O)C
Canonical SMILES
C=C(C1=CC(=O)C(C)(C)O1)[C@@H]1CC=C([C@@H]2CC[C@H]3[C@@]2(C)CC[C@H]2C(C)(C)[C@@H](O)[C@H](O)C[C@]32C)[C@H](O)O1

Names & Synonyms

  • Sodagnitin E
  • RefChem:183496
  • CHEBI:199142
  • CID10743997
  • CID 10743997
  • J1.065.292H
  • (3R,5aalpha,9balpha)-3beta-[[(2R)-2beta-Hydroxy-6beta-[1-[(4-oxo-5,5-dimethyl-4,5-dihydrofuran)-2-yl]vinyl]-5,6-dihydro-2H-pyran]-3-yl]-3abeta,6,6,9abeta-tetramethyldodecahydro-1H-benzo[e]indene-7beta,8alpha-diol
  • 5-(1-((2S,6R)-5-((3R,3aR,5aR,7R,8R,9aR,9bS)-7,8-dihydroxy-3a,6,6,9a-tetramethyl-1,2,3,4,5,5a,7,8,9,9b-decahydrocyclopenta(a)naphthalen-3-yl)-6-hydroxy-3,6-dihydro-2H-pyran-2-yl)ethenyl)-2,2-dimethylfuran-3-one
  • 5-[1-[(2S,6R)-5-[(3R,3aR,5aR,7R,8R,9aR,9bS)-7,8-dihydroxy-3a,6,6,9a-tetramethyl-1,2,3,4,5,5a,7,8,9,9b-decahydrocyclopenta[a]naphthalen-3-yl]-6-hydroxy-3,6-dihydro-2H-pyran-2-yl]ethenyl]-2,2-dimethylfuran-3-one
  • 5-[1-[(2S,6R)-5-[(3R,3aR,5aR,7R,8R,9aR,9bS)-7,8-dihydroxy-3a,6,6,9a-tetramethyl-1,2,3,4,5,5a,7,8,9,9b-decahydrocyclopenta[a]naphthalen-3-yl]-6-hydroxy-3,6-dihydro-2H-pyran-2-yl]ethenyl]-2,2-dimethyluran-3-one
  • 5-{1-[(2S,6R)-5-[(3R,3aR,5aR,7R,8R,9aR,9bS)-7,8-dihydroxy-3a,6,6,9a-tetramethyl-dodecahydro-1H-cyclopenta[a]naphthalen-3-yl]-6-hydroxy-3,6-dihydro-2H-pyran-2-yl]ethenyl}-2,2-dimethyl-2,3-dihydrofuran-3-one