Ethylbenzene (BioCAD00000010797)
Metabolite Card
Formula: C8H10 (106.0782)
SMILES: CCC1=CC=CC=C1
Synonyms [en]
ethylbenzene; Ethylbenzol; Phenylethane; Ethylenzene; alpha-Methyltoluene; Aethylbenzol
Last reviewed on 2024-06-28.
Cite this Page
Ethylbenzene. 数据之源，洞见之始. SMRUCC genomics institute, a synthetic life researcher from China.
https://biocad_registry.innovation.ac.cn/s/(-)-arctiin
(retrieved
2026-01-03) (CAD Registry RN: BioCAD00000010797). Licensed
under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).
Note
Ethylbenzene belongs to the family of Substituted Benzenes. These are aromatic compounds containing a benzene substituted at one or more positions.
DBLinks
- CAS Registry Number: 100-41-4
- PubChem CID: 7500
- ChEBI: 16101
- HMDB: HMDB0059905
- LipidMaps:
- KEGG: C07111
- BioCyc: ETHYLBENZENE
- NCBI MeSH: ethylbenzene
- Wikipedia: Ethylbenzene
Other DBLinks
- CAS Registry Number: 100-41-4
- CAS Registry Number: 158507-69-8
- CAS Registry Number: 17203-53-1
- CAS Registry Number: 20302-26-5
- CAS Registry Number: 2348-51-8
- CAS Registry Number: 27536-89-6
- CAS Registry Number: 287399-33-1
- CAS Registry Number: 68908-88-3
- CAS Registry Number: 70955-17-8
- PubChem: 7500
- ChEBI: ChEBI:16101
- HMDB: HMDB0059905
- KEGG: C07111
- BioCyc: ETHYLBENZENE
- NCBI MeSH: ethylbenzene
- Wikipedia: Ethylbenzene
- DrugBank: DB01722
- RefMet: RM0021425
- MoNA: HMDB0059905_c_ms_102414
- MoNA: HMDB0059905_c_ms_102415
- MoNA: HMDB0059905_c_ms_102416
- MoNA: JP000961
- MoNA: JP001672
- MoNA: JP012245
- Metlin: METLIN_66590
- Coconut NaturalProduct: CNP0245508.0
Class / Ontology
- WishartLab ClassyFire: [Benzene and substituted derivatives] Benzene and substituted derivatives
- RefMet: [Other benzenes] Other benzenes
- ChEBI: [CHEBI:16101] ethylbenzene
| ID | EC Number | Name |
|---|---|---|
| KEGG:R05424 | 1.14.12.12 | C07111<=>C07083 + 2 C00080 |
| KEGG:R05425 | 1.14.12.12 | C07111 + C00007 + C00004 + C00080<=>C11348 + C00003 + C00001 |
| KEGG:R05440 | 1.14.12.- | C07111 + C00007 + C00004 + C00080<=>C06727 + C00003 |
| KEGG:R05495 | 1.17.-.- | C07111 + C00001<=>C07112 + 2 C00080 |
| KEGG:R05745 | 1.17.99.2 | ethylbenzene:(acceptor) oxidoreductase |
| Rhea:RHEA:17898 | 1.17.99.2 | ethylbenzene + A + H2O => (S)-1-phenylethanol + AH2 |
| Rhea:RHEA:17899 | 1.17.99.2 | (S)-1-phenylethanol + AH2 => ethylbenzene + A + H2O |
| Rhea:RHEA:17900 | 1.17.99.2 | ethylbenzene + A + H2O <=> (S)-1-phenylethanol + AH2 |
| BioCyc:RXN-1301 | 1.17.99.2 | ETHYLBENZENE + WATER + Acceptor --> S-1-PHENYLETHANOL + Donor-H2 |
Taxonomy Source
- Acorus gramineus [ncbi taxid: 55184]
- Acorus tatarinowii [ncbi taxid: 123564]
- Artemisia capillaris [ncbi taxid: 265783]
- Artemisia dracunculus [ncbi taxid: 72341]
- Bryophyllum pinnatum [ncbi taxid: ]
- Carlina vulgaris [ncbi taxid: 41500]
- Carthamus tinctorius [ncbi taxid: 4222]
- Citrus aurantifolia [ncbi taxid: ]
- Citrus aurantium [ncbi taxid: ]
- Citrus hystrix [ncbi taxid: 170989]
- Citrus limon [ncbi taxid: ]
- Citrus paradisi [ncbi taxid: ]
- Citrus reticulata [ncbi taxid: 85571]
- Citrus sinensis [ncbi taxid: 2711]
- Citrus unshiu [ncbi taxid: 55188]
- Crocus sativus [ncbi taxid: 82528]
- Curcuma longa [ncbi taxid: 136217]
- Cynanchum paniculatum [ncbi taxid: ]
- Hansenia forbesii [ncbi taxid: 165499]
- Hansenia weberbaueriana [ncbi taxid: 54724]
- Homo sapiens [ncbi taxid: 9606]
- Juglans nigra [ncbi taxid: 16719]
- Nerium oleander [ncbi taxid: 63479]
- Ostericum grosseserratum [ncbi taxid: 182415]
- Polygala sibirica [ncbi taxid: 690825]
- Polygala tenuifolia [ncbi taxid: 355332]
- Polygonatum odoratum [ncbi taxid: 82207]
- Ruellia tuberosa [ncbi taxid: 441035]
- Vincetoxicum pycnostelma [ncbi taxid: ]
Pathway Synthetic
| pathway id | name |
|---|---|
| BioCyc:META_PWY-481 | ethylbenzene degradation (anaerobic) |
| BioCyc:THAPS_PWY-481 | ethylbenzene degradation (anaerobic) |