CHEBI:217890 - (-)-bipolaride E

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
This entity has been annotated by a third party. If you would like more information added to this entry, please contact ChEBI via email or GitHub.
ChEBI Name (-)-bipolaride E
ChEBI ID CHEBI:217890
Stars This entity has been manually annotated by a third party.
Submitter MetaboLights
Supplier Information
Download Molfile XML SDF
Formula C18H18O5
Net Charge 0
Average Mass 314.337
Monoisotopic Mass 314.11542
InChI InChI=1S/C18H18O5/c1-7-6-9(21-5)15-11-10(7)16-13(18(3,4)8(2)22-16)14(19)12(11)17(20)23-15/h6,8,19H,1-5H3/t8-/m0/s1
InChIKey IAXFDOUFJCSYAU-QMMMGPOBSA-N
SMILES O=C1OC=2C(OC)=CC(=C3C2C1=C(O)C4=C3O[C@H](C4(C)C)C)C
Metabolite of Species Details
Lophiostoma (NCBI:txid45148) See: PubMed
ChEBI Ontology
Outgoing (-)-bipolaride E (CHEBI:217890) is a naphthofuran (CHEBI:39270)
IUPAC Name
(4S)-7-hydroxy-12-methoxy-4,5,5,14-tetramethyl-3,10-dioxatetracyclo[6.6.1.02,6.011,15]pentadeca-1(15),2(6),7,11,13-pentaen-9-one
Manual Xref Database
44210986 ChemSpider
View more database links