loading...| Preferred Name |
Eugenol |
|
| Synonyms |
2-methoxy-4-(prop-2-en-1-yl)phenol Eugenol eugenol 4-Hydroxy-3-methoxy-1-allylbenzene 2-Methoxy-4-(2-propenyl)phenol p-Allylguaiacol 2-Methoxy-4-prop-2-enylphenol 2-Methoxy-4-(2-propen-1-yl)phenol 2-Methoxy-4-allylphenol 4-Allyl-2-methoxyphenol 4-Allylcatechol-2-methyl ether 1,3,4-Eugenol Eugenic acid 2-Methoxy-1-hydroxy-4-allylbenzene Caryophyllic acid 4-allyl-2-methoxyphenol 1-Hydroxy-2-methoxy-4-allylbenzene 1-Hydroxy-2-methoxy-4-prop-2-enylbenzene Allylguaiacol 2-Hydroxy-5-allylanisole 1-allyl-4-hydroxy-3-methoxybenzene 1-Hydroxy-2-methoxy-4-propenylbenzene 2-methoxy-4-(2-propen-1-yl)phenol 2-methoxy-4-prop-2-enyl-phenol 1-allyl-3-methoxy-4-hydroxybenzene 4-Allyl-1-hydroxy-2-methoxybenzene 4-Allylguaiacol p-Eugenol |
|
| Definitions |
A phenylpropanoid formally derived from guaiacol with an allyl chain substituted para to the hydroxy group. It is a major component of clove essential oil, and exhibits antibacterial, analgesic and antioxidant properties. It has been widely used in dentistry to treat toothache and pulpitis. |
|
| ID |
http://purl.obolibrary.org/obo/CHEBI_4917 |
|
| charge |
0 |
|
| database_cross_reference |
HMDB:HMDB0005809 PMID:23707945 KEGG:C10453 PMID:23666640 PMID:22923067 PMID:23677922 PMID:9084914 PMID:23444040 PMID:15574415 Drug_Central:4648 PMID:23325490 CAS:97-53-0 PMID:23313798 PMID:2329164 PMID:8596779 PMID:20809147 PMID:29079364 PMID:11033063 PMID:23261812 KEGG:D04117 Chemspider:13876103 PMID:23181601 MetaCyc:CPD-6481 FooDB:FDB012171 PMID:23837051 Wikipedia:Eugenol PMID:23841789 PMID:32737935 PMID:23791894 Beilstein:1366759 PMID:23264268 PMID:28044068 PMID:33291666 KNApSAcK:C00000619 LINCS:LSM-2720 Reaxys:1366759 PMID:23422484 PMID:23422489 PDBeChem:EOL PMID:11806158 PMID:23594212 PMID:14745850 PMID:23768604 PMID:23768603 PMID:23852671 PMID:33916044 PMID:18218839 PMID:22075131 BPDB:2008 |
|
| definition |
A phenylpropanoid formally derived from guaiacol with an allyl chain substituted para to the hydroxy group. It is a major component of clove essential oil, and exhibits antibacterial, analgesic and antioxidant properties. It has been widely used in dentistry to treat toothache and pulpitis. |
|
| formula |
C10H12O2 |
|
| has functional parent | ||
| has role |
http://purl.obolibrary.org/obo/CHEBI_35610 http://purl.obolibrary.org/obo/CHEBI_85234 http://purl.obolibrary.org/obo/CHEBI_27311 http://purl.obolibrary.org/obo/CHEBI_38867 http://purl.obolibrary.org/obo/CHEBI_33282 http://purl.obolibrary.org/obo/CHEBI_50904 http://purl.obolibrary.org/obo/CHEBI_68495 http://purl.obolibrary.org/obo/CHEBI_38623 http://purl.obolibrary.org/obo/CHEBI_73240 http://purl.obolibrary.org/obo/CHEBI_35617 http://purl.obolibrary.org/obo/CHEBI_35480 http://purl.obolibrary.org/obo/CHEBI_67079 http://purl.obolibrary.org/obo/CHEBI_139492 |
|
| has_exact_synonym |
2-methoxy-4-(prop-2-en-1-yl)phenol Eugenol eugenol |
|
| has_obo_namespace |
chebi_ontology |
|
| has_related_synonym |
4-Hydroxy-3-methoxy-1-allylbenzene 2-Methoxy-4-(2-propenyl)phenol p-Allylguaiacol 2-Methoxy-4-prop-2-enylphenol 2-Methoxy-4-(2-propen-1-yl)phenol 2-Methoxy-4-allylphenol 4-Allyl-2-methoxyphenol 4-Allylcatechol-2-methyl ether 1,3,4-Eugenol Eugenic acid 2-Methoxy-1-hydroxy-4-allylbenzene Caryophyllic acid 4-allyl-2-methoxyphenol 1-Hydroxy-2-methoxy-4-allylbenzene 1-Hydroxy-2-methoxy-4-prop-2-enylbenzene Allylguaiacol 2-Hydroxy-5-allylanisole 1-allyl-4-hydroxy-3-methoxybenzene 1-Hydroxy-2-methoxy-4-propenylbenzene 2-methoxy-4-(2-propen-1-yl)phenol 2-methoxy-4-prop-2-enyl-phenol 1-allyl-3-methoxy-4-hydroxybenzene 4-Allyl-1-hydroxy-2-methoxybenzene 4-Allylguaiacol p-Eugenol |
|
| has_RxCUI |
4186 |
|
| id |
CHEBI:4917 |
|
| in_subset | ||
| inchi |
InChI=1S/C10H12O2/c1-3-4-8-5-6-9(11)10(7-8)12-2/h3,5-7,11H,1,4H2,2H3 |
|
| inchikey |
RRAFCDWBNXTKKO-UHFFFAOYSA-N |
|
| label |
Eugenol eugenol |
|
| mass |
164.204 |
|
| monoisotopicmass |
164.08373 |
|
| notation |
CHEBI:4917 |
|
| prefLabel |
Eugenol |
|
| smiles |
COC1=CC(CC=C)=CC=C1O |
|
| subClassOf |
http://purl.obolibrary.org/obo/CHEBI_25235 http://purl.obolibrary.org/obo/CHEBI_33853 |