Aspergillic Acid

Aspergillic Acid bmse001279 - Data

Aspergillic Acid synonyms

Wikipedia:

Graphical representations:

Aspergillic

View large 3D structure

Molecular Formula: C12H20N2O2

Natural Isotopic Abundance Mass: 224.2994

Mono-Isotopic Molecular Masses:

  • C12N14: 224.15247789
  • C13N14: 236.192735946
  • C12N15: 226.146547676
  • C13N15: 238.186805732

InChI string: InChI=1S/C12H20N2O2/c1-5-9(4)11-7-13-10(6-8(2)3)12(15)14(11)16/h7-9,16H,5-6H2,1-4H3/t9-/m1/s1

PubChem Compound (CID): 10272
NSC:

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, https://www.nature.com/articles/sdata201773)