CHEBI:5659 - hentriacontane

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
ChEBI Name hentriacontane
ChEBI ID CHEBI:5659
Stars This entity has been manually annotated by the ChEBI Team.
Supplier Information
Download Molfile XML SDF
Formula C31H64
Net Charge 0
Average Mass 436.83986
Monoisotopic Mass 436.501
InChI InChI=1S/C31H64/c1-3-5-7-9-11-13-15-17-19-21-23-25-27-29-31-30-28-26-24-22-20-18-16-14-12-10-8-6-4-2/h3-31H2,1-2H3
InChIKey IUJAMGNYPWYUPM-UHFFFAOYSA-N
SMILES CCCCCCCCCCCCCCCCCCCCCCCCCCCCCCC
Roles Classification
Biological Role(s): antitubercular agent
A substance that kills or slows the growth of Mycobacterium tuberculosis and is used in the treatment of tuberculosis.
Application(s): antitubercular agent
A substance that kills or slows the growth of Mycobacterium tuberculosis and is used in the treatment of tuberculosis.
View more via ChEBI Ontology
ChEBI Ontology
Outgoing hentriacontane (CHEBI:5659) has role antitubercular agent (CHEBI:33231)
hentriacontane (CHEBI:5659) is a long-chain alkane (CHEBI:83563)
Incoming hentriacontan-1-ol (CHEBI:27640) has parent hydride hentriacontane (CHEBI:5659)
hentriacontan-16-ol (CHEBI:35985) has parent hydride hentriacontane (CHEBI:5659)
hentriacontan-16-one (CHEBI:5658) has parent hydride hentriacontane (CHEBI:5659)
hentriacontane-14,16-dione (CHEBI:5660) has parent hydride hentriacontane (CHEBI:5659)
IUPAC Name
hentriacontane
Synonyms Sources
CH3‒[CH2]29‒CH3 IUPAC
Hentriacontan ChEBI
Hentriacontane KEGG COMPOUND
n-hentriacontane NIST Chemistry WebBook
Database Links Databases
C00001250 KNApSAcK
C08376 KEGG COMPOUND
View more database links
Registry Numbers Types Sources
1709817 Beilstein Registry Number Beilstein
630-04-6 CAS Registry Number ChemIDplus
630-04-6 CAS Registry Number NIST Chemistry WebBook
Last Modified
11 November 2014