Chemical Compound

Pro-dehydromonocrotaline

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Pro-dehydromonocrotaline chemical structure
Primary Record

Pro-dehydromonocrotaline

In stock
550 g
Purity
98.1 %

Compound Identifiers & Properties

PubChem CID
100961978
SMILES
C[C@H]1C(=O)O[C@@H]2CCN([C@@H]2/C(=C\C=O)/COC(=O)[C@]([C@@]1(C)O)(C)O)C(=O)OCC3=CC(=C(C=C3[N+](=O)[O-])OC)OC
Canonical SMILES
COc1cc(COC(=O)N2CC[C@H]3OC(=O)[C@H](C)[C@](C)(O)[C@@](C)(O)C(=O)OC/C(=C/C=O)[C@H]32)c([N+](=O)[O-])cc1OC

Names & Synonyms

  • Pro-dehydromonocrotaline
  • J1.097.485B
  • (1R,4R,10E,11R)-3,7-Dioxo-4alpha,5beta,6alpha-trimethyl-5,6-dihydroxy-10-(2-oxoethylidene)-2,8-dioxa-12-azabicyclo[9.3.0]tetradecane-12-carboxylic acid 3,4-dimethoxy-6-nitrobenzyl ester
  • (4,5-dimethoxy-2-nitrophenyl)methyl (3aR,6R,7S,8R,12E,12aR)-7,8-dihydroxy-6,7,8-trimethyl-5,9-dioxo-12-(2-oxoethylidene)-dodecahydro-1,6-dioxacycloundeca[3,2-b]pyrrole-1-carboxylate