Chemical Components in the PDB

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F09 : Summary

Code

F09

One-letter code

X

Molecule name

NONAN-1-OL

Systematic names

ProgramVersionName
ACDLabs 10.04 nonan-1-ol
OpenEye OEToolkits 1.5.0 nonan-1-ol

Formula

C9 H20 O

Formal charge

0

Molecular weight

144.254 Da

SMILES

TypeProgramVersionDescriptor
SMILES ACDLabs 10.04 OCCCCCCCCC
SMILES CACTVS 3.341 CCCCCCCCCO
SMILES OpenEye OEToolkits 1.5.0 CCCCCCCCCO
Canonical SMILES CACTVS 3.341 CCCCCCCCCO
Canonical SMILES OpenEye OEToolkits 1.5.0 CCCCCCCCCO

IUPAC InChI

InChI=1S/C9H20O/c1-2-3-4-5-6-7-8-9-10/h10H,2-9H2,1H3

IUPAC InChI key

ZWRUINPWMLAQRD-UHFFFAOYSA-N
F09

wwPDB Information

Atom count

30 (10 without Hydrogen)

Polymer type

Bound ligand

Type description

NON-POLYMER

Type code

HETAIN

Is modified

No

Standard parent

Not Assigned

Defined at

2001-10-31

Last modified at

2011-06-04

Status

Released

Obsoleted

Not Assigned