Chemical Compound

Xylarinonericin A

Xylarinonericin A chemical structure
Primary Record

Xylarinonericin A

In stock
550 g
Purity
98.1 %

Compound Identifiers & Properties

PubChem CID
73334297
SMILES
C[C@@H]1CC[C@@H]2[C@@H]1C[C@@]3([C@@H]4C[C@]2([C@]3(C(=C4)C(C)C)C(=O)O[C@H]5C(=O)C=C([C@@H]([C@]5(C)O)O)OC)C=O)CO
Canonical SMILES
COC1=CC(=O)[C@H](OC(=O)[C@@]23C(C(C)C)=C[C@H]4C[C@]2(C=O)[C@@H]2CC[C@@H](C)[C@H]2C[C@]43CO)[C@@](C)(O)[C@H]1O

Names & Synonyms

  • Xylarinonericin A
  • J3.269.549C
  • (1R,5R,6S)-5,6-dihydroxy-4-methoxy-6-methyl-2-oxocyclohex-3-en-1-yl (1R,2S,4R,5R,8R,9S,11R)-9-formyl-2-(hydroxymethyl)-5-methyl-13-(propan-2-yl)tetracyclo[7.4.0.02,11.04,8]tridec-12-ene-1-carboxylate
  • 3-Isopropyl-4beta-formyl-7beta-methyl-8abeta-(hydroxymethyl)-1alpha,4-methano-1,3a,4,4abeta,5,6,7,7aalpha,8,8a-decahydro-s-indacene-3abeta-carboxylic acid 2-oxo-4-methoxy-5alpha,6alpha-di-hydroxy-6-methyl-3-cyclohexene-1beta-yl ester