EMBL-EBI | Chemical Biology | ChEBI

Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search

CHEBI:207281 - Eutypellazine H

ChEBI IDCHEBI:207281
ChEBI NameEutypellazine H
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC19H22N2O6S2
Net Charge0
Average Mass438.527
Monoisotopic Mass438.09193
SMILESCS[C@@]12CC3C(=O)CC[C@H](O)[C@H]3N1C(=O)[C@]13C[C@@]4(O)[C@H](C=C[C@H](O)[C@H]4N1C2=O)S3
InChIInChI=1S/C19H22N2O6S2/c1-28-18-6-8-9(22)2-3-10(23)13(8)20(18)16(26)19-7-17(27)12(29-19)5-4-11(24)14(17)21(19)15(18)25/h4-5,8,10-14,23-24,27H,2-3,6-7H2,1H3/t8?,10-,11-,12-,13-,14+,17+,18+,19+/m0/s1
InChIKeyYWODZHGUJIDJFE-RUUDMYEHSA-N
Species of MetaboliteComponentSourceComments
Eutypella (ncbitaxon:140192) - DOI (10.1039/c7ra05774a)
ChEBI Ontology
Outgoing Relation(s)
Eutypellazine H (CHEBI:207281) has functional parent α-amino acid (CHEBI:33704)
Eutypellazine H (CHEBI:207281) is a organonitrogen compound (CHEBI:35352)
Eutypellazine H (CHEBI:207281) is a organooxygen compound (CHEBI:36963)
IUPAC Name 
(1R,4S,5S,11R,14R,15S,18S,19S)-5,15,19-trihydroxy-11-methylsulanyl-21-thia-3,13-diazahexacyclo[16.2.1.01,13.03,11.04,9.014,19]henicos-16-ene-2,8,12-trione
Manual XrefsDatabases
62277933ChemSpider