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CHEBI:207246 - Eutypellazine B

ChEBI IDCHEBI:207246
ChEBI NameEutypellazine B
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SubmitterMetaboLights
DownloadsMolfile
FormulaC19H22N2O5S2
Net Charge0
Average Mass422.528
Monoisotopic Mass422.09701
SMILESCS[C@@]12CC3=CC=C[C@H](O)[C@H]3N1C(=O)[C@@]13C[C@@H]4[C@@H]([C@@H](O)[C@@H](C[C@@H]4O)S1)N3C2=O
InChIInChI=1S/C19H22N2O5S2/c1-27-18-6-8-3-2-4-10(22)13(8)20(18)17(26)19-7-9-11(23)5-12(28-19)15(24)14(9)21(19)16(18)25/h2-4,9-15,22-24H,5-7H2,1H3/t9-,10-,11-,12+,13-,14-,15-,18+,19+/m0/s1
InChIKeyGYXDEGFLWPXLBO-DXXLCSEDSA-N
Species of MetaboliteComponentSourceComments
Eutypella (ncbitaxon:140192) - DOI (10.1039/c7ra05774a)
ChEBI Ontology
Outgoing Relation(s)
Eutypellazine B (CHEBI:207246) has functional parent α-amino acid (CHEBI:33704)
Eutypellazine B (CHEBI:207246) is a organonitrogen compound (CHEBI:35352)
Eutypellazine B (CHEBI:207246) is a organooxygen compound (CHEBI:36963)
IUPAC Name 
(1R,4S,5S,11R,14S,15R,16R,18S,19R)-5,15,18-trihydroxy-11-methylsulanyl-21-thia-3,13-diazahexacyclo[14.4.1.01,13.03,11.04,9.014,19]henicosa-6,8-diene-2,12-dione
Manual XrefsDatabases
62277927ChemSpider