PFAS
Global PFAS Screening Tool
No. of Substances: 18960
CID 101303498
CAS Number: 40898-35-9
IUPAC name: (2S)-2-amino-3-[[(1S)-1-amino-1-carboxy-2-methylpropan-2-yl]sulfanyl-[4-[(4,6-diamino-1,3,5-triazin-2-yl)amino]phenyl]arsanyl]sulfanyl-3-methylbutanoic acid
Molecular formula: C19H29AsN8O4S2
Molecular weight: 572.5
InChI: InChI=1S/C19H29AsN8O4S2/c1-18(2,11(21)13(29)30)33-20(34-19(3,4)12(22)14(31)32)9-5-7-10(8-6-9)25-17-27-15(23)26-16(24)28-17/h5-8,11-12H,21-22H2,1-4H3,(H,29,30)(H,31,32)(H5,23,24,25,26,27,28)/t11-,12-/m0/s1
InChIKey: VCEKMIUVWWILSK-RYUDHWBXSA-N
SMILES: CC(C)([C@H](C(=O)O)N)S[As](C1=CC=C(C=C1)NC2=NC(=NC(=N2)N)N)SC(C)(C)[C@H](C(=O)O)N
EINECS: -
