Chemical Components in the PDB

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FSW : Summary

Code

FSW

One-letter code

X

Molecule name

methyl 6-deoxy-2-Se-methyl-2-seleno-alpha-L-galactopyranoside

Synonyms

(2S,3S,4R,5S,6R)-6-methoxy-2-methyl-5-methylselanyl-oxane-3,4-diol
methyl 6-deoxy-2-Se-methyl-2-seleno-alpha-L-galactoside
methyl 6-deoxy-2-Se-methyl-2-seleno-L-galactoside
methyl 6-deoxy-2-Se-methyl-2-seleno-galactoside

Systematic names

ProgramVersionName
OpenEye OEToolkits 2.0.6 (2~{S},3~{S},4~{R},5~{S},6~{R})-6-methoxy-2-methyl-5-methylselanyl-oxane-3,4-diol

Formula

C8 H16 O4 Se

Formal charge

0

Molecular weight

255.17 Da

SMILES

TypeProgramVersionDescriptor
SMILES CACTVS 3.385 CO[CH]1O[CH](C)[CH](O)[CH](O)[CH]1[Se]C
SMILES OpenEye OEToolkits 2.0.6 CC1C(C(C(C(O1)OC)[Se]C)O)O
Canonical SMILES CACTVS 3.385 CO[C@@H]1O[C@@H](C)[C@@H](O)[C@@H](O)[C@@H]1[Se]C
Canonical SMILES OpenEye OEToolkits 2.0.6 C[C@H]1[C@H]([C@H]([C@@H]([C@@H](O1)OC)[Se]C)O)O

IUPAC InChI

InChI=1S/C8H16O4Se/c1-4-5(9)6(10)7(13-3)8(11-2)12-4/h4-10H,1-3H3/t4-,5+,6+,7-,8+/m0/s1

IUPAC InChI key

GFGVRXDXSFUDNW-FMGWEMOISA-N
FSW

wwPDB Information

Atom count

29 (13 without Hydrogen)

Polymer type

Saccharide

Type description

L-saccharide

Type code

ATOMS

Is modified

No

Standard parent

Not Assigned

Defined at

2016-11-02

Last modified at

2020-07-17

Status

Released

Obsoleted

Not Assigned