Biological Magnetic Resonance Data Bank

A Repository for Data from NMR Spectroscopy on Proteins, Peptides, Nucleic Acids, and other Biomolecules
Member of WWPDB


2_3_Diacetoxypropioveratrone synonyms



Graphical representations:


View large 3D structure

Molecular Formula: C15H18O7

Natural Isotopic Abundance Mass: 310.29922

Mono-Isotopic Molecular Masses:

  • C12N14: 310.1052529325
  • C13N14: 325.1555754995
  • C12N15: 310.1052529325
  • C13N15: 325.1555754995

InChI string: InChI=1S/C15H18O7/c1-9(16)21-8-14(22-10(2)17)15(18)11-5-6-12(19-3)13(7-11)20-4/h5-7,14H,8H2,1-4H3/t14-/m0/s1

USDA_NMR_database: 1

Reference data were obtained primarily from the PubChem database.

Three dimensional molecular rendering uses Jmol.

InChI string and atom numbering calculated using ALATIS (Hesam Dashti, William M. Westler, John L. Markley, Hamid R. Eghbalnia, "Unique identifiers for small molecules enable rigorous labeling of their atoms", Scientific Data 4, Article number: 170073 (2017), doi:10.1038/sdata.2017.73,