CHEBI:217841 - Rubrumline L

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 Rubrumline L
ChEBI ID CHEBI:217841
Stars This entity has been manually annotated by a third party.
Submitter MetaboLights
Supplier Information
Download Molfile XML SDF
Formula C23H27N3O5
Net Charge 0
Average Mass 425.485
Monoisotopic Mass 425.19507
InChI InChI=1S/C23H27N3O5/c1-6-22(2,3)18-14(11-16-19(28)26-21(30)20(29)25-16)13-9-12(7-8-15(13)24-18)10-17(27)23(4,5)31/h6-9,11,17,27,31H,1,10H2,2-5H3,(H,25,29)(H2,26,28,30)/t17-/m0/s1
InChIKey XIAZZKRVHOZPFA-KRWDZBQOSA-N
SMILES O=C1NC(O)=C(C=C2C3=C(C=CC(=C3)C[C@H](O)C(O)(C)C)N=C2C(C=C)(C)C)NC1=O
Metabolite of Species Details
Aspergillus ruber (NCBI:txid396024) See: PubMed
ChEBI Ontology
Outgoing Rubrumline L (CHEBI:217841) is a indoles (CHEBI:24828)
IUPAC Name
5-[[5-[(2S)-2,3-dihydroxy-3-methylbutyl]-2-(2-methylbut-3-en-2-yl)indol-3-ylidene]methyl]-6-hydroxy-1,4-dihydropyrazine-2,3-dione