Loading
PDBj
MenuPDBj@FacebookPDBj@TwitterPDBj@YouTubewwPDB FoundationwwPDB
RCSB PDBPDBeBMRBAdv. SearchSearch help

R16

Summary
Name:HEXADECANE
Formula:C16 H34
Formal charge:0
Formula weight:226.441 Da
Component type:NON-POLYMER

Chemical Identifiers

ProgramVersionName
ACDLabs10.04hexadecane
OpenEye OEToolkits1.5.0hexadecane

Chemical Descriptors

TypeProgramVersionDescriptor
SMILESACDLabs10.04CCCCCCCCCCCCCCCC
SMILES_CANONICALCACTVS3.341CCCCCCCCCCCCCCCC
SMILESCACTVS3.341CCCCCCCCCCCCCCCC
SMILES_CANONICALOpenEye OEToolkits1.5.0CCCCCCCCCCCCCCCC
SMILESOpenEye OEToolkits1.5.0CCCCCCCCCCCCCCCC
InChIInChI1.03InChI=1S/C16H34/c1-3-5-7-9-11-13-15-16-14-12-10-8-6-4-2/h3-16H2,1-2H3
InChIKeyInChI1.03DCAYPVUWAIABOU-UHFFFAOYSA-N

221051

PDB entries from 2024-06-12

PDB statisticsPDBj update infoContact PDBjnumon