dihydrosterigmatocystin

Chemical Formula:

C₁₈H₁₄O₆

Molecular Weight:

326.305 Daltons

Monoisotopic Mass:

326.079038182 Daltons

SMILES:

COC1(C4(=C(C2([CH]3(CCO[CH](OC(C=1)=2)3)))OC5(C=CC=C(C(C4=O)=5)O)))

InChI:

1S/C18H14O6/c1-21-11-7-12-13(8-5-6-22-18(8)24-12)17-15(11)16(20)14-9(19)3-2-4-10(14)23-17/h2-4,7-8,18-19H,5-6H2,1H3/t8-,18+/m0/s1

InChIKey:

RHGQIWVTIHZRLI-DCXZOGHSSA-N

Databases

MetaCyc: CPD-4587

KEGG: C20445

PubChem (CID): 21596453

MetaboLights: MTBLC72677

HMDB: HMDB30590

ChEBI: 72677

ChemSpider: 4588884

Seed: cpd24510

MetaNetX: MNXM11389