The Biofilms Structural Database

Back

GALBG0

3ZYH

Code

G0S

Name

3-(beta-D-galactopyranosylthio)propanoic acid

Molecular Weight

268.28

Isomeric SMILES

OC[[email protected]]1O[[email protected]@H](SCCC(O)=O)[[email protected]](O)[[email protected]@H](O)[[email protected]]1O

Formula

C9H16O7S

Identifiers

3-[(2S,3R,4S,5R,6R)-6-(hydroxymethyl)-3,4,5-tris(oxidanyl)oxan-2-yl]sulfanylpropanoic acid

Formal Charge

0

InChI

InChI=1S/C9H16O7S/c10-3-4-6(13)7(14)8(15)9(16-4)17-2-1-5(11)12/h4,6-10,13-15H,1-3H2,(H,11,12)/t4-,6+,7+,8-,9+/m1/s1

Atom Count

33

InChIKey

XMQYQVUZHDCFEM-MRCFXUCSSA-N

PDB codes

3ZYH

Type

non-polymer

Chiral Atom Count

5

Chiral Atoms

C1, C2, C3, C4, C5

Bond Count

33

Aromatic Bond Count

0

Leaving Atoms

OXT