Benzo[a]pyrene-9,10-oxide (BioCAD00000007154)
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Metabolite Card
Formula: C20H12O (268.0888)
SMILES: O1C2C=CC3=C(C12)C1=C2C(C=CC4=C2C(C=C1)=CC=C4)=C3
Synonyms [en]
Benzo[a]pyrene-9,10-oxide; Benzo[a]pyrene-9,10-epoxide; 2-b)oxirene; OLLMQFHYRYHKTD-UHFFFAOYSA-N; 11)chryseno(1; 4-oxahexacyclo11.6.2.02
Last reviewed on 2024-06-28.
Cite this Page
Benzo[a]pyrene-9,10-oxide. 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: BioCAD00000007154). Licensed
under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).
Note
This compound belongs to the family of Pyrenes. These are compounds containing a pyrene moiety, which consists four fused benzene rings, resulting in a flat aromatic system.
DBLinks
- CAS Registry Number: 36504-66-2
- PubChem CID: 37456
- ChEBI: 34564
- HMDB: HMDB0060090
- LipidMaps:
- KEGG: C14849
- BioCyc:
- NCBI MeSH:
- Wikipedia:
Other DBLinks
- CAS Registry Number: 36504-66-2
- PubChem: 37456
- ChEBI: ChEBI:34564
- HMDB: HMDB0060090
- KEGG: C14849
- Metlin: METLIN_70354
- Coconut NaturalProduct: CNP0147047.0
- Coconut NaturalProduct: CNP0403095.0
Class / Ontology
- WishartLab ClassyFire: [Pyrenes] Pyrenes
- ChEBI: [CHEBI:34564] Benzo[a]pyrene-9,10-oxide
- Coconut NaturalProduct: [Phenanthrenes] Phenanthrenes
| ID | EC Number | Name |
|---|---|---|
| KEGG:R07079 | 1.14.14.1 | benzpyrene,NADPH:oxygen oxidoreductase (RH-hydroxylating or -epoxidizing) |
| KEGG:R07086 | C14849<=>C14556 |