S-b-S-r-S

S-b-S-r-S bmse010125 - Data

S_b_S_r_S synonyms

Wikipedia:

Graphical representations:

S_b_S_r_S

View large 3D structure

Molecular Formula: C33H40O13

Natural Isotopic Abundance Mass: 644.6629

Mono-Isotopic Molecular Masses:

  • C12N14: 644.2468913713
  • C13N14: 677.3576010187
  • C12N15: 644.2468913713
  • C13N15: 677.3576010187

InChI string: InChI=1S/C33H40O13/c1-38-21-7-16(8-22(39-2)29(21)36)28(35)27(13-34)46-33-25(42-5)11-18(12-26(33)43-6)32-20-15-44-31(19(20)14-45-32)17-9-23(40-3)30(37)24(10-17)41-4/h7-12,19-20,27-28,31-32,34-37H,13-15H2,1-6H3/t19-,20-,27+,28+,31-,32-/m1/s1

USDA_NMR_database: 198

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)