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OCD

Summary
Name:octadecanal
Formula:C18 H36 O
Formal charge:0
Formula weight:268.478 Da
Component type:NON-POLYMER

Chemical Identifiers

ProgramVersionName
ACDLabs12.01octadecanal
OpenEye OEToolkits2.0.5octadecanal

Chemical Descriptors

TypeProgramVersionDescriptor
SMILESACDLabs12.01C(CCCCCCCCCCCCCCCCC)=O
InChIInChI1.03InChI=1S/C18H36O/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19/h18H,2-17H2,1H3
InChIKeyInChI1.03FWWQKRXKHIRPJY-UHFFFAOYSA-N
SMILES_CANONICALCACTVS3.385CCCCCCCCCCCCCCCCCC=O
SMILESCACTVS3.385CCCCCCCCCCCCCCCCCC=O
SMILES_CANONICALOpenEye OEToolkits2.0.5CCCCCCCCCCCCCCCCCC=O
SMILESOpenEye OEToolkits2.0.5CCCCCCCCCCCCCCCCCC=O

218853

PDB entries from 2024-04-24

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