Chemical Components in the PDB

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Z5J : Summary

Code

Z5J

One-letter code

X

Molecule name

beta-L-Olivopyranose

Systematic names

ProgramVersionName
ACDLabs 12.01 2,6-dideoxy-beta-L-arabino-hexopyranose
OpenEye OEToolkits 1.7.6 (4S,5R,6S)-6-methyloxane-2,4,5-triol

Formula

C6 H12 O4

Formal charge

0

Molecular weight

148.157 Da

SMILES

TypeProgramVersionDescriptor
SMILES ACDLabs 12.01 OC1C(OC(O)CC1O)C
SMILES CACTVS 3.370 C[CH]1O[CH](O)C[CH](O)[CH]1O
SMILES OpenEye OEToolkits 1.7.6 CC1C(C(CC(O1)O)O)O
Canonical SMILES CACTVS 3.370 C[C@@H]1O[C@H](O)C[C@H](O)[C@H]1O
Canonical SMILES OpenEye OEToolkits 1.7.6 C[C@H]1[C@@H]([C@H](CC(O1)O)O)O

IUPAC InChI

InChI=1S/C6H12O4/c1-3-6(9)4(7)2-5(8)10-3/h3-9H,2H2,1H3/t3-,4-,5-,6-/m0/s1

IUPAC InChI key

FDWRIIDFYSUTDP-BXKVDMCESA-N
Z5J

wwPDB Information

Atom count

22 (10 without Hydrogen)

Polymer type

Saccharide

Type description

L-saccharide, beta linking

Type code

ATOMS

Is modified

No

Standard parent

Not Assigned

Defined at

2012-12-18

Last modified at

2020-07-17

Status

Released

Obsoleted

Not Assigned