scopoletin

Chemical Formula:

C₁₀H₈O₄

Molecular Weight:

192.171 Daltons

Monoisotopic Mass:

192.0422587452 Daltons

SMILES:

COC2(C=C1(C(OC(=O)C=C1)=CC=2O))

InChI:

1S/C10H8O4/c1-13-9-4-6-2-3-10(12)14-8(6)5-7(9)11/h2-5,11H,1H3

InChIKey:

RODXRVNMMDRFIK-UHFFFAOYSA-N

Synonyms

Databases

MetaCyc: SCOPOLETIN

RefMet: Scopoletin

MetaboLights: MTBLC17488

HMDB: HMDB34344

ChemSpider: 4444113

PubChem (CID): 5280460

ChEBI: 17488

KEGG: C01752

NCI: 405647

Seed: cpd01209

MetaNetX: MNXM3357