aloesone

Chemical Formula:

C₁₃H₁₂O₄

Molecular Weight:

232.235 Daltons

Monoisotopic Mass:

232.07355887359998 Daltons

SMILES:

CC1(C2(C(=O)C=C(OC(C=C(O)C=1)=2)CC(=O)C))

InChI:

1S/C13H12O4/c1-7-3-9(15)5-12-13(7)11(16)6-10(17-12)4-8(2)14/h3,5-6,15H,4H2,1-2H3

InChIKey:

JHELBXAAAYUKCT-UHFFFAOYSA-N

Synonyms

Databases

MetaCyc: CPD-6801

MetaboLights: MTBLC59878

ChemSpider: 4476484

ChEBI: 59878

PubChem (CID): 5317700

Seed: cpd24660

MetaNetX: MNXM8280