Molfinder
Home
Support
About Us
Data Source
Statistics
Blogs
Substance
ID:1823595
Structure
Similarity
Functional Group
Text
ID:2647
heptanoic acid
Chemical Entities of Biological Interest
ID: CHEBI:45571
Names and Identifiers
IUPAC Traditional name
heptanoic acid
IUPAC name
heptanoic acid
Synonyms
heptanoic acid
CH3-[CH2]5-COOH
HEPTANOIC ACID
Heptansaeure
Oenanthsaeure
enanthic acid
enanthylic acid
heptoic acid
heptylic acid
n-heptanoic acid
n-heptoic acid
n-heptylic acid
oenanthic acid
oenanthylic acid
Registration numbers
CAS Number
111-14-8
Beilstein Number
1744723
PubChem CID
8094
KEGG ID
C17714
DrugBank ID
DB02938
Wikipedia Title
Heptanoic_acid
LIPID MAPS Instance
LMFA01010007
MetaCyc Database
CPD-7619
PubMed Citation Links
23999410
Reaxys Registry
1744723
ACToR Database
7563-37-3
68937-74-6
111-14-8
BKMS React Database
137282
4648
BRENDA Database
1.1.1.10
1.1.3.15
6.2.1.3
1.14.15.3
6.2.1.14
6.2.1.1
3.1.1.4
3.5.1.39
1.2.1.20
1.2.1.47
1.2.5.2
3.7.1.2
1.2.1.3
1.2.1.39
1.1.99.20
1.2.1.48
1.2.3.1
1.2.1.4
1.2.1.5
3.5.1.97
3.5.1.13
1.2.1.24
3.1.1.1
1.2.1.16
3.5.5.5
3.5.5.7
3.5.5.1
3.5.1.99
1.2.1.77
1.2.3.14
1.2.3.7
6.2.1.12
6.2.1.2
6.2.1.13
2.7.2.18
2.7.2.1
BRENDA Ligand Database
137282
4648
CHEMBL
CHEMBL320358
CompTox Database
DTXSID2021600
MetaboLights Database
MTBLS4507
MTBLS530
MTBLS653
MTBLS804
MTBLS802
MTBLS4012
MTBLS2841
MTBLS135
MTBLS136
MTBLS1386
MTBLS2615
MTBLS1267
MTBLS1302
MTBLS1636
MTBLS1980
MTBLS298
MTBLS2945
MTBLS1866
MTBLS392
MTBLS212
MTBLS219
Protein Data Bank
1po8
4q95
4rw3
5xna
6bba
6pmd
SABIO-RK Database
7997
12029
13163
6917
8085
13575
SureChEMBL Database
SCHEMBL3564
SCHEMBL20552731
UniProt Database
A0JC77
B1VTI7
A0JC76
HMDB Database
HMDB0000666
PDBeChem Database
SHV
Golm Database
d67f1385-8a2a-456d-8018-3403f9b5a56d
7df13206-5f16-41fb-abc4-9ede159c5148
52abc796-c603-4f14-aa58-e617df317a70
d0391aad-e046-44ed-85c2-fc4da9176ddf
188d2aca-493e-4ab4-a73a-cf40dc31a3d6
NMRShiftDB Database
10008718
Patent number
WO2005014539
EP1344769
EP1649857
EP1709960
EP1745791
EP1929995
US2003077595
US2003199582
US2004242594
US2007185063
US2007196301
US2007196384
US2007245500
US2007248560
US2008009613
WO2005011656
WO2005012297
WO2005079790
WO2005105079
WO2006020234
WO2006021216
WO2006056845
WO2006061366
WO2007106049
EP0947523
GB2152376
US2002137660
WO2006032959
Reactom Database
R-HSA-9712201
R-HSA-9712208
R-HSA-9712210
Gmelin ID
142428
CHEBI ID
CHEBI:45571
CHEBI:45568
CHEBI:24519
PubChem SID
26697132
Properties
No Data Available
Click here to submit data
Molecule Details
A C7, straight-chain fatty acid that contributes to the odour of some rancid oils. Used in the preparation of esters for the fragrance industry, and as an additive in cigarettes.
Molecular Spectra
No Data Available
Click here to submit data
References
No Data Available
Click here to submit data
Quote
Download
Navigation
General Information
Names and Identifiers
Registration numbers
Properties
Molecule Details
Molecular Spectra
References