sterigmatocystin
Chemical Formula:
C18H12O6
Molecular Weight:
324.289 Daltons
Monoisotopic Mass:
324.0633881178 Daltons
SMILES:
COC5(=CC2(=C([CH]1([CH](OC=C1)O2))C4(OC3(=C(C(=CC=C3)O)C(=O)C=45))))
InChI:
1S/C18H12O6/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/h2-8,18-19H,1H3/t8-,18+/m0/s1
InChIKey:
Databases
MetaCyc:
STERIGMATOCYSTIN
RefMet:
Sterigmatocystin
ChEBI:
18227
PubChem (CID):
5280389
MetaboLights:
MTBLC18227
HMDB:
HMDB30588
ChemSpider:
4447522
KEGG:
C00961
NCI:
204985
CAS:
10048-13-2
Seed:
cpd00708
MetaNetX:
MNXM2284