VI3

(2~{R})-2-azanyl-3-[bis(oxidanylidene)-$l^{5}-sulfanyl]propanoic acid

Created:	2023-03-07
Last modified:	2024-09-27

Find Related PDB Entry
4 entries where VI3 is found in a polymer sequence

Find related ligands:

Similar Ligands (Stereospecific) Similar Ligands (including Stereoisomers) Similar Ligands (Quick Screen) Similar Ligands (Substructure Stereospecific) Similar Ligands (Substructure including Stereoisomers)

Chemical Details
Formal Charge	-1
Atom Count	15
Chiral Atom Count	1
Bond Count	14
Aromatic Bond Count	0

2D diagram of VI3

Toggle Hydrogen Toggle Labels

Chemical Component Summary
Name	(2~{R})-2-azanyl-3-[bis(oxidanylidene)-$l^{5}-sulfanyl]propanoic acid
Systematic Name (OpenEye OEToolkits)	(2~{R})-2-azanyl-3-sulfinato-propanoic acid
Formula	C₃ H₆ N O₄ S
Molecular Weight	152.149
Type	L-PEPTIDE LINKING

Chemical Descriptors
Type	Program	Version	Descriptor
SMILES	CACTVS	3.385	N[CH](C[S-](=O)=O)C(O)=O
SMILES	OpenEye OEToolkits	2.0.7	C(C(C(=O)O)N)[S-](=O)=O
Canonical SMILES	CACTVS	3.385	N[C@@H](C[S-](=O)=O)C(O)=O
Canonical SMILES	OpenEye OEToolkits	2.0.7	C([C@@H](C(=O)O)N)[S-](=O)=O
InChI	InChI	1.06	InChI=1S/C3H6NO4S/c4-2(3(5)6)1-9(7)8/h2H,1,4H2,(H,5,6)/q-1/t2-/m0/s1
InChIKey	InChI	1.06	RRLRIWQWKHHDRA-REOHCLBHSA-N

RCSB PDB Core Operations are funded by the U.S. National Science Foundation (DBI-2321666), the US Department of Energy (DE-SC0019749), and the National Cancer Institute, National Institute of Allergy and Infectious Diseases, and National Institute of General Medical Sciences of the National Institutes of Health under grant R01GM157729.