charge
label: بار @fa

formula
label: فرمول @fa

inchi
label: اینچی @fa

inchikey
label: اینچی‌کی @fa

mass
label: جرم @fa

monoisotopicmass
label: جرم تک‌ایزوتوپی @fa

smiles
label: اسمایلٓ @fa

subset
label: زیرمجموعه @fa

synonym EXACT
label: مترادف دقیق @fa

asp-tyr-glu
type: Concept
charge: 0
formula: C18H23N3O9
inchi: InChI=1S/C18H23N3O9/c19-11(8-15(25)26)16(27)21-13(7-9-1-3-10(22)4-2-9)17(28)20-12(18(29)30)5-6-14(23)24/h1-4,11-13,22H,5-8,19H2,(H,20,28)(H,21,27)(H,23,24)(H,25,26)(H,29,30)/t11-,12-,13-/m0/s1
inchikey: KNDCWFXCFKSEBM-AVGNSLFASA-N
mass: 425.394
monoisotopicmass: 425.14343
subset: 2_STAR
synonym EXACT: (2S)-2-[[(2S)-2-[[(2S)-2-amino-3-carboxypropanoyl]amino]-3-(4-hydroxyphenyl)propanoyl]amino]pentanedioic acid
broader: peptide
preferred label: Asp Tyr Glu @fa

peptide
type: Concept
narrower: asp-tyr-glu
preferred label: پپتید @fa