isopimpinellin

Chemical Formula:

C₁₃H₁₀O₅

Molecular Weight:

246.219 Daltons

Monoisotopic Mass:

246.05282343149997 Daltons

SMILES:

COC3(C1(C=COC=1C(OC)=C2(OC(=O)C=CC2=3)))

InChI:

1S/C13H10O5/c1-15-10-7-3-4-9(14)18-12(7)13(16-2)11-8(10)5-6-17-11/h3-6H,1-2H3

InChIKey:

DFMAXQKDIGCMTL-UHFFFAOYSA-N

Synonyms

Databases

MetaCyc: CPD-15049

RefMet: Isopimpinellin

KEGG: C02162

PubChem (CID): 68079

HMDB: HMDB34312

ChEBI: 28853

Seed: cpd01463

MetaNetX: MNXM5796