CHEBI:227393 - 2,8-dichlororugulovasine A

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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 2,8-dichlororugulovasine A
ChEBI ID CHEBI:227393
Stars This entity has been manually annotated by a third party.
Submitter MetaboLights
Supplier Information
Download Molfile XML SDF
Formula C16H14Cl2N2O2
Net Charge 0
Average Mass 337.200
Monoisotopic Mass 336.04323
InChI InChI=1S/C16H14Cl2N2O2/c1-7-6-16(22-15(7)21)9-3-4-10(17)13-12(9)8(14(18)20-13)5-11(16)19-2/h3-4,6,11,19-20H,5H2,1-2H3/t11-,16+/m1/s1
InChIKey IENLABAWRVNXDR-BZNIZROVSA-N
SMILES ClC1=C2NC(Cl)=C3C2=C([C@]4(OC(=O)C(=C4)C)[C@H](NC)C3)C=C1
Metabolite of Species Details
Talaromyces wortmannii (NCBI:txid28567) See: PubMed
ChEBI Ontology
Outgoing 2,8-dichlororugulovasine A (CHEBI:227393) is a indoles (CHEBI:24828)
IUPAC Name
(4R,5S)-2,8-dichloro-3'-methyl-4-(methylamino)spiro[3,4-dihydro-1H-benzo[cd]indole-5,5'-uran]-2'-one
Manual Xref Database
78441940 ChemSpider
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