S-Adenosyl-L-homocysteine
S_Adenosyl_L_homocysteine synonyms
D-Ribitol, 5-S-(3-amino-3-carboxypropyl)-1-C-(7-amino-1H-pyrazolo(4,3-d)pyrimidin-3-yl)-1,4-anhydro-5-thio-, (1S,5(S))-; BRN 5166233; Formycinylhomocysteine; S-Adenosylhomocysteine
Graphical representations:
View large 3D structure
Molecular Formula: C14H20N6O5S
Natural Isotopic Abundance Mass: 384.4108000000
Mono-Isotopic Molecular Masses:
- C12N14: 384.121588474
- C13N14: 398.168556203
- C12N15: 390.103797833
- C13N15: 398.168556203
InChI string: InChI=1/C14H20N6O5S/c15-6(14(23)24)1-2-26-3-7-9(21)10(22)13(25-7)20-5-19-8-11(16)17-4-18-12(8)20/h4-7,9-10,13,21-22H,1-3,15H2,(H,23,24)(H2,16,17,18)/t6-,7+,9+,10+,13+/m0/s1/f/h23H,16H2
IUPAC: (2S)-2-amino-4-[[(2R,3R,4R,5R)-5-(6-aminopurin-9-yl)-3,4-dihydroxy-oxolan-2-yl]methylsulfanyl]butanoic acid
PubChem Compound (CID): 439155KEGG Compound ID: C00021
ChemIDplus: 075899148
CAS Registry number: 979-92-0 75899-14-8
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)