dihydrodemethylsterigmatocystin
Chemical Formula:
C17H12O6
Molecular Weight:
312.278 Daltons
Monoisotopic Mass:
312.0633881178 Daltons
SMILES:
C4(=CC5(OC1(=C(C(O)=CC2(O[CH]3(OCC[CH](C1=2)3)))C(=O)C(C(O)=C4)=5)))
InChI:
1S/C17H12O6/c18-8-2-1-3-10-13(8)15(20)14-9(19)6-11-12(16(14)22-10)7-4-5-21-17(7)23-11/h1-3,6-7,17-19H,4-5H2/t7-,17+/m0/s1
InChIKey:
Databases
MetaCyc:
CPD-4586
KEGG:
C20444
PubChem (CID):
20832874
HMDB:
HMDB33658
ChemSpider:
4588953
Seed:
cpd24509
MetaNetX:
MNXM11375