G-b-S-b-S

G-b-S-b-S bmse010165 - Data

G_b_S_b_S synonyms

Wikipedia:

Graphical representations:

G_b_S_b_S

View large 3D structure

Molecular Formula: C40H48O17

Natural Isotopic Abundance Mass: 800.79892

Mono-Isotopic Molecular Masses:

  • C12N14: 800.2891501165
  • C13N14: 840.4233436285
  • C12N15: 800.2891501165
  • C13N15: 840.4233436285

InChI string: InChI=1S/C40H48O17/c1-21-14-31(47-8)39(32(15-21)48-9)57-36(20-52-23(3)42)38(55-26(6)45)28-17-33(49-10)40(34(18-28)50-11)56-35(19-51-22(2)41)37(54-25(5)44)27-12-13-29(53-24(4)43)30(16-27)46-7/h12-18,35-38H,19-20H2,1-11H3/t35-,36+,37-,38+/m0/s1

USDA_NMR_database: 250

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)